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Update materials_science_and_engineering domain with 50 ontologies

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  1. README.md +85 -0
  2. amontology/amontology.rst +73 -0
  3. amontology/amontology.ttl +0 -0
  4. amontology/term_typings.json +415 -0
  5. amontology/type_non_taxonomic_relations.json +49 -0
  6. amontology/type_taxonomies.json +3562 -0
  7. asmo/asmo.owl +0 -0
  8. asmo/asmo.rst +70 -0
  9. asmo/term_typings.json +212 -0
  10. asmo/type_non_taxonomic_relations.json +26 -0
  11. asmo/type_taxonomies.json +585 -0
  12. atomistic/atomistic.rst +68 -0
  13. atomistic/atomistic.ttl +203 -0
  14. atomistic/term_typings.json +1 -0
  15. atomistic/type_non_taxonomic_relations.json +5 -0
  16. atomistic/type_taxonomies.json +4 -0
  17. battinfo/battinfo.rst +71 -0
  18. battinfo/battinfo.ttl +72 -0
  19. battinfo/term_typings.json +72 -0
  20. battinfo/type_non_taxonomic_relations.json +25 -0
  21. battinfo/type_taxonomies.json +1151 -0
  22. bmo/bmo.rst +69 -0
  23. bmo/bmo.ttl +781 -0
  24. bmo/term_typings.json +86 -0
  25. bmo/type_non_taxonomic_relations.json +5 -0
  26. bmo/type_taxonomies.json +129 -0
  27. bvco/bvco.rst +71 -0
  28. bvco/bvco.ttl +0 -0
  29. bvco/term_typings.json +1 -0
  30. bvco/type_non_taxonomic_relations.json +5 -0
  31. bvco/type_taxonomies.json +4 -0
  32. cdco/cdco.owl +382 -0
  33. cdco/cdco.rst +69 -0
  34. cdco/term_typings.json +1 -0
  35. cdco/type_non_taxonomic_relations.json +5 -0
  36. cdco/type_taxonomies.json +32 -0
  37. chameo/chameo.rst +72 -0
  38. chameo/chameo.ttl +0 -0
  39. chameo/term_typings.json +1 -0
  40. chameo/type_non_taxonomic_relations.json +25 -0
  41. chameo/type_taxonomies.json +1151 -0
  42. cifcore/cifcore.rst +70 -0
  43. cifcore/cifcore.ttl +0 -0
  44. cifcore/term_typings.json +1 -0
  45. cifcore/type_non_taxonomic_relations.json +5 -0
  46. cifcore/type_taxonomies.json +0 -0
  47. cmso/cmso.owl +1478 -0
  48. cmso/cmso.rst +69 -0
  49. cmso/term_typings.json +1 -0
  50. cmso/type_non_taxonomic_relations.json +16 -0
README.md ADDED
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1
+
2
+ ---
3
+ license: mit
4
+ language:
5
+ - en
6
+ tags:
7
+ - OntoLearner
8
+ - ontology-learning
9
+ - materials_science_and_engineering
10
+ pretty_name: Agricultural
11
+ ---
12
+ <div>
13
+ <img src="https://raw.githubusercontent.com/sciknoworg/OntoLearner/main/images/logo.png" alt="OntoLearner"
14
+ style="display: block; margin: 0 auto; width: 500px; height: auto;">
15
+ <h1 style="text-align: center; margin-top: 1em;">Materials Science And Engineering Domain Ontologies</h1>
16
+ </div>
17
+
18
+ ## Overview
19
+ Materials Science and Engineering is a multidisciplinary domain that focuses on the study and application of materials, emphasizing their structure, properties, processing, and performance in engineering contexts. This field is pivotal in advancing knowledge representation by systematically categorizing and interrelating complex material phenomena, enabling the development of innovative materials and technologies. Through the integration of computational, experimental, and theoretical approaches, it facilitates the design and optimization of materials for diverse industrial applications, thereby driving technological progress and sustainability.
20
+
21
+ ## Ontologies
22
+ | Ontology ID | Full Name | Classes | Properties | Last Updated |
23
+ |-------------|-----------|---------|------------|--------------|
24
+ | AMOntology | Additive Manufacturing Ontology (AMOntology) | 328 | 21 | 2023-05-10|
25
+ | ASMO | Atomistic Simulation Methods Ontology (ASMO) | 99 | 41 | None|
26
+ | Atomistic | Atomistic Ontology (Atomistic) | 12 | 2 | None|
27
+ | BattINFO | Battery Interface Ontology (BattINFO) | 4431 | 304 | None|
28
+ | BMO | Building Material Ontology (BMO) | 24 | 62 | 2019-12-10|
29
+ | BVCO | Battery Value Chain Ontology (BVCO) | 262 | 6 | None|
30
+ | CDCO | Crystallographic Defect Core Ontology (CDCO) | 7 | 2 | None|
31
+ | CHAMEO | Characterisation Methodology Domain Ontology (CHAMEO) | 203 | 52 | 2024-04-12|
32
+ | CIFCore | Crystallographic Information Framework (CIF) Core Dictionary (CIFCore) | 1182 | 0 | May 24, 2023|
33
+ | CMSO | Computational Material Sample Ontology (CMSO) | 45 | 51 | None|
34
+ | DISO | Dislocation Ontology (DISO) | 62 | 45 | 21.03.202|
35
+ | DSIM | Dislocation Simulation and Model Ontology (DSIM) | 47 | 78 | 17.08.2023|
36
+ | EMMO | The Elementary Multiperspective Material Ontology (EMMO) | 2448 | 181 | 2024-03|
37
+ | EMMOCrystallography | Crystallography Ontology (EMMOCrystallography) | 61 | 5 | None|
38
+ | FSO | Flow Systems Ontology (FSO) | 14 | 22 | 2020-08-06|
39
+ | GPO | General Process Ontology (GPO) | 187 | 17 | None|
40
+ | HPOnt | The Heat Pump Ontology (HPOnt) | 4 | 12 | None|
41
+ | LDO | Line Defect Ontology (LDO) | 30 | 11 | None|
42
+ | LPBFO | Laser Powder Bed Fusion Ontology (LPBFO) | 508 | 38 | 2022-09-20|
43
+ | MAMBO | Molecules And Materials Basic Ontology (MAMBO) | 57 | 104 | None|
44
+ | MAT | Material Properties Ontology (MAT) | 140 | 21 | None|
45
+ | MaterialInformation | Material Information Ontology (MaterialInformation) | 548 | 98 | None|
46
+ | MatOnto | Material Ontology (MatOnto) | 1307 | 95 | None|
47
+ | MatVoc | Materials Vocabulary (MatVoc) | 28 | 15 | 2022-12-12|
48
+ | MatWerk | NFDI MatWerk Ontology (MatWerk) | 449 | 129 | 2025-03-01|
49
+ | MDO | Materials Design Ontology (MDO) | 13 | 13 | 2022-08-02|
50
+ | MDS | Materials Data Science Ontology (MDS) | 363 | 10 | 03/24/2024|
51
+ | MechanicalTesting | Mechanical Testing Ontology (MechanicalTesting) | 369 | 5 | None|
52
+ | MicroStructures | EMMO-based ontology for microstructures (MicroStructures) | 43 | 0 | None|
53
+ | MMO | Materials Mechanics Ontology (MMO) | 428 | 17 | 2024-01-30|
54
+ | MOLBRINELL | MatoLab Brinell Test Ontology (MOL_BRINELL) | 37 | 21 | 05/05/2022|
55
+ | MOLTENSILE | Matolab Tensile Test Ontology (MOL_TENSILE) | 371 | 95 | 04/16/2021|
56
+ | MSEO | Materials Science and Engineering Ontology (MSEO) | 138 | 2 | None|
57
+ | MSLE | Material Science Lab Equipment Ontology (MSLE) | 45 | 10 | Sep 15, 2022|
58
+ | NanoMine | NanoMine Ontology (NanoMine) | 157 | 0 | None|
59
+ | OIECharacterisation | Open Innovation Environment (OIE) domain ontologies, Characterisation module (OIECharacterisation) | 42 | 0 | None|
60
+ | OIEManufacturing | Open Innovation Environment (OIE) domain ontologies, Manufacturing module (OIEManufacturing) | 222 | 3 | None|
61
+ | OIEMaterials | Open Innovation Environment (OIE) domain ontologies, Materials module (OIEMaterials) | 119 | 0 | None|
62
+ | OIEModels | Open Innovation Environment (OIE) domain ontologies, Models module (OIEModels) | 108 | 1 | None|
63
+ | OIESoftware | Open Innovation Environment (OIE) domain ontologies, Software module (OIESoftware) | 155 | 0 | None|
64
+ | ONTORULE | Ontology for the Steel Domain (ONTORULE) | 24 | 37 | 2010-05-31|
65
+ | PeriodicTable | Periodic Table of the Elements Ontology (PeriodicTable) | 6 | 13 | 2004/02/05|
66
+ | Photovoltaics | EMMO Domain Ontology for Photovoltaics (Photovoltaics) | 47 | 3 | None|
67
+ | PLDO | Planar Defects Ontology (PLDO) | 27 | 15 | None|
68
+ | PMDco | The Platform MaterialDigital core ontology (PMDco) | 1002 | 66 | 2025-03-20|
69
+ | PODO | Point Defects Ontology (PODO) | 12 | 5 | None|
70
+ | PRIMA | PRovenance Information in MAterials science (PRIMA) | 67 | 67 | 2024-01-29|
71
+ | SSN | Semantic Sensor Network Ontology (SSN) | 22 | 38 | 2017-04-17|
72
+ | SystemCapabilities | System capabilities, operating ranges, and survival ranges ontology (SystemCapabilities) | 25 | 8 | 2017-05-14|
73
+ | VIMMP | Virtual Materials Marketplace (VIMMP) Ontologies | 1234 | 771 | 2021-01-02|
74
+
75
+ ## Dataset Files
76
+ Each ontology directory contains the following files:
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+ 1. `<ontology_id>.<format>` - The original ontology file
78
+ 2. `term_typings.json` - Dataset of term to type mappings
79
+ 3. `taxonomies.json` - Dataset of taxonomic relations
80
+ 4. `non_taxonomic_relations.json` - Dataset of non-taxonomic relations
81
+ 5. `<ontology_id>.rst` - Documentation describing the ontology
82
+
83
+ ## Usage
84
+ These datasets are intended for ontology learning research and applications.
85
+
amontology/amontology.rst ADDED
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1
+ Additive Manufacturing Ontology (AMOntology)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ The AM ontology has been developed following two major milestones. The ontology developed within the first milestone
7
+ includes AMProcessOntology, ModelOntology and AMOntology files. AMProcessOntology contains the set of entities
8
+ used to capture knowledge about additive manufacturing processes. ModelOntology contains the set of entities
9
+ used to capture knowledge about modeling concepts that represent (possibly) multi-physics multi-scale processes.
10
+ AMOntology uses AMProcessOntology and ModelOntology files to describe entities that capture knowledge
11
+ about characteristics of computational models for AM processes.
12
+
13
+ :Domain: Materials Science and Engineering
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+ :Category: Manufacturing
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+ :Current Version: 1.0
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+ :Last Updated: 2023-05-10
17
+ :Creator: Iassou Souroko, Ali Riza Durmaz
18
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
19
+ :Format: TTL
20
+ :Download: `Additive Manufacturing Ontology (AMOntology) Homepage <https://github.com/iassouroko/AMontology>`_
21
+
22
+ Graph Metrics
23
+ -------------
24
+ - **Total Nodes**: 900
25
+ - **Total Edges**: 2299
26
+ - **Root Nodes**: 71
27
+ - **Leaf Nodes**: 99
28
+
29
+ Knowledge coverage
30
+ ------------------
31
+ - Classes: 328
32
+ - Individuals: 56
33
+ - Properties: 21
34
+
35
+ Hierarchical metrics
36
+ --------------------
37
+ - **Maximum Depth**: 15
38
+ - **Minimum Depth**: 0
39
+ - **Average Depth**: 4.66
40
+ - **Depth Variance**: 11.25
41
+
42
+ Breadth metrics
43
+ ------------------
44
+ - **Maximum Breadth**: 116
45
+ - **Minimum Breadth**: 1
46
+ - **Average Breadth**: 55.50
47
+ - **Breadth Variance**: 1339.25
48
+
49
+ Dataset Statistics
50
+ ------------------
51
+ Generated Benchmarks:
52
+ - **Term Types**: 59
53
+ - **Taxonomic Relations**: 657
54
+ - **Non-taxonomic Relations**: 5
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+ - **Average Terms per Type**: 1.26
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+
57
+ Usage Example
58
+ -------------
59
+ .. code-block:: python
60
+
61
+ from ontolearner.ontology import AMOntology
62
+
63
+ # Initialize and load ontology
64
+ ontology = AMOntology()
65
+ ontology.load("path/to/ontology.TTL")
66
+
67
+ # Extract datasets
68
+ data = ontology.extract()
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+
70
+ # Access specific relations
71
+ term_types = data.term_typings
72
+ taxonomic_relations = data.type_taxonomies
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+ non_taxonomic_relations = data.type_non_taxonomic_relations
amontology/amontology.ttl ADDED
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amontology/term_typings.json ADDED
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1
+ [
2
+ {
3
+ "ID": "TT_b76dedb5",
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+ "term": "LiMa_ConsolidationInitialCondition",
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+ "types": [
6
+ "ConsolidationInitialCondition"
7
+ ]
8
+ },
9
+ {
10
+ "ID": "TT_69cc095a",
11
+ "term": "LiMa_ScanningSpeed",
12
+ "types": [
13
+ "ScanningSpeed"
14
+ ]
15
+ },
16
+ {
17
+ "ID": "TT_af188b3e",
18
+ "term": "TemperatureDependentDensityOfTheSolid",
19
+ "types": [
20
+ "ConsolidationModelingAssumption"
21
+ ]
22
+ },
23
+ {
24
+ "ID": "TT_44ed8a79",
25
+ "term": "SurfaceHeatAbsorption",
26
+ "types": [
27
+ "SurfaceDistributionOfAbsorbedHeat"
28
+ ]
29
+ },
30
+ {
31
+ "ID": "TT_2305140b",
32
+ "term": "LiMa_LaserSurfaceHeatFlux",
33
+ "types": [
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+ "SurfaceDistributionOfAbsorbedHeat"
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+ ]
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+ },
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+ {
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+ "ID": "TT_62a0bca9",
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+ "term": "LiMa_ConsolidationModel",
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+ "types": [
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+ "ConsolidationByMeltingModel"
42
+ ]
43
+ },
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+ {
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+ "ID": "TT_ac0cf798",
46
+ "term": "LiMa_InputHeatFlux",
47
+ "types": [
48
+ "TopBoundaryCondition"
49
+ ]
50
+ },
51
+ {
52
+ "ID": "TT_4f2c423d",
53
+ "term": "LiMa_TopBoundaryCondition",
54
+ "types": [
55
+ "TopBoundaryCondition"
56
+ ]
57
+ },
58
+ {
59
+ "ID": "TT_221d1776",
60
+ "term": "LiMa_SurfaceConvection",
61
+ "types": [
62
+ "TopBoundaryCondition"
63
+ ]
64
+ },
65
+ {
66
+ "ID": "TT_f65660ce",
67
+ "term": "LiMa_Radiation",
68
+ "types": [
69
+ "TopBoundaryCondition"
70
+ ]
71
+ },
72
+ {
73
+ "ID": "TT_bbef04ab",
74
+ "term": "LiMa_RadiusOfTheLaserBeam",
75
+ "types": [
76
+ "BeamSize"
77
+ ]
78
+ },
79
+ {
80
+ "ID": "TT_00c3619b",
81
+ "term": "LiMa_LaserPowderBedFusionProcess",
82
+ "types": [
83
+ "SelectiveLaserMelting"
84
+ ]
85
+ },
86
+ {
87
+ "ID": "TT_4db66b93",
88
+ "term": "LiMa_Inconel625",
89
+ "types": [
90
+ "Material"
91
+ ]
92
+ },
93
+ {
94
+ "ID": "TT_cec06e9d",
95
+ "term": "DeterministicLaserHeatFlux",
96
+ "types": [
97
+ "DeterministicIrradiation"
98
+ ]
99
+ },
100
+ {
101
+ "ID": "TT_55f88a86",
102
+ "term": "LiMa_DensityOfThePowderBed",
103
+ "types": [
104
+ "DensityDistribution"
105
+ ]
106
+ },
107
+ {
108
+ "ID": "TT_add278ab",
109
+ "term": "LiMa_PhaseChangesAssumption",
110
+ "types": [
111
+ "PhaseTransformationAssumption"
112
+ ]
113
+ },
114
+ {
115
+ "ID": "TT_93e260e9",
116
+ "term": "GaussianSurfaceDistributionOfHeat",
117
+ "types": [
118
+ "GaussianDistribution"
119
+ ]
120
+ },
121
+ {
122
+ "ID": "TT_abb21d4b",
123
+ "term": "LiMa_GaussianDistribution",
124
+ "types": [
125
+ "GaussianDistribution"
126
+ ]
127
+ },
128
+ {
129
+ "ID": "TT_9be1c354",
130
+ "term": "TemperatutreDependentPowderPackingRatio",
131
+ "types": [
132
+ "LawOfPhysicsForConsolidation"
133
+ ]
134
+ },
135
+ {
136
+ "ID": "TT_b1d9f541",
137
+ "term": "LiMa_PreheatTemperature",
138
+ "types": [
139
+ "InitialDistributionOfTemperature"
140
+ ]
141
+ },
142
+ {
143
+ "ID": "TT_51fbcf0b",
144
+ "term": "LiMa_ThermalPhysicalProperty",
145
+ "types": [
146
+ "HeatTransferProperty"
147
+ ]
148
+ },
149
+ {
150
+ "ID": "TT_35dd3021",
151
+ "term": "LiMa_SideBoundaryCondition",
152
+ "types": [
153
+ "SideBoundaryCondition"
154
+ ]
155
+ },
156
+ {
157
+ "ID": "TT_ae69a060",
158
+ "term": "LiMa_PowderPackingRatio",
159
+ "types": [
160
+ "PackingDensity"
161
+ ]
162
+ },
163
+ {
164
+ "ID": "TT_99b52a25",
165
+ "term": "LiMa_AdiabaticBoundaryCondition",
166
+ "types": [
167
+ "AdiabaticBC"
168
+ ]
169
+ },
170
+ {
171
+ "ID": "TT_7ddd16ce",
172
+ "term": "LiMa_Emissivity",
173
+ "types": [
174
+ "Emissivity"
175
+ ]
176
+ },
177
+ {
178
+ "ID": "TT_47f8314f",
179
+ "term": "LiMa_InitialPowderPackingRatio",
180
+ "types": [
181
+ "InitialPowderDensity"
182
+ ]
183
+ },
184
+ {
185
+ "ID": "TT_da4c8c5a",
186
+ "term": "LiMa_ThermalConductivityOfThePowderBed",
187
+ "types": [
188
+ "ThermalConductivityInPowderBed"
189
+ ]
190
+ },
191
+ {
192
+ "ID": "TT_6c02ecb8",
193
+ "term": "LiMa_ThermalModel",
194
+ "types": [
195
+ "HeatTransferModel"
196
+ ]
197
+ },
198
+ {
199
+ "ID": "TT_bc84eb7b",
200
+ "term": "LiMa_HeatConductionModel",
201
+ "types": [
202
+ "HeatTransferModel"
203
+ ]
204
+ },
205
+ {
206
+ "ID": "TT_c3cc3c9d",
207
+ "term": "LiMa_DensityOfThePowderBed",
208
+ "types": [
209
+ "ConsolidationModelPrediction"
210
+ ]
211
+ },
212
+ {
213
+ "ID": "TT_5e51c3f5",
214
+ "term": "LiMa_HeatConductionPhenomenon",
215
+ "types": [
216
+ "HeatTransfer"
217
+ ]
218
+ },
219
+ {
220
+ "ID": "TT_66bac9e8",
221
+ "term": "LiMa_IrradiationAbsorptionModel",
222
+ "types": [
223
+ "IrradiationAbsorptionModel"
224
+ ]
225
+ },
226
+ {
227
+ "ID": "TT_bf13c2a5",
228
+ "term": "ConstantAbsorptivity",
229
+ "types": [
230
+ "BeerLambertLaw"
231
+ ]
232
+ },
233
+ {
234
+ "ID": "TT_07206cf0",
235
+ "term": "LiMa_LaserSurfaceHeatFlux",
236
+ "types": [
237
+ "Prediction"
238
+ ]
239
+ },
240
+ {
241
+ "ID": "TT_4728d46b",
242
+ "term": "LiMa_TemperatureHistoryOutput",
243
+ "types": [
244
+ "Prediction"
245
+ ]
246
+ },
247
+ {
248
+ "ID": "TT_13617844",
249
+ "term": "LiMa_BoundaryCondition",
250
+ "types": [
251
+ "ThermalBoundaryCondition"
252
+ ]
253
+ },
254
+ {
255
+ "ID": "TT_7f1612f6",
256
+ "term": "LiMa_HeatConductionInitialCondition",
257
+ "types": [
258
+ "ThermalInitialCondition"
259
+ ]
260
+ },
261
+ {
262
+ "ID": "TT_d54fdfc2",
263
+ "term": "ConstantPreheatTemperature",
264
+ "types": [
265
+ "ThermalInitialCondition"
266
+ ]
267
+ },
268
+ {
269
+ "ID": "TT_724be478",
270
+ "term": "LiMa_LaserPower",
271
+ "types": [
272
+ "HeatSourcePower"
273
+ ]
274
+ },
275
+ {
276
+ "ID": "TT_eb604e07",
277
+ "term": "LiMa_IrradiationAbsorptionModelingAssumption",
278
+ "types": [
279
+ "IrradiationAbsorptionModelingAssumption"
280
+ ]
281
+ },
282
+ {
283
+ "ID": "TT_da211d70",
284
+ "term": "LiMa_ConsolidationPhysicalProperty",
285
+ "types": [
286
+ "ConsolidationPhysicalProperty"
287
+ ]
288
+ },
289
+ {
290
+ "ID": "TT_de932b4c",
291
+ "term": "LiMa_BottomBoundaryCondition",
292
+ "types": [
293
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81
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82
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83
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85
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86
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88
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106
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107
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161
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168
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169
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171
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185
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186
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189
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191
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892
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902
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907
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912
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925
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1800
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1856
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1861
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1871
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1876
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1880
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1881
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1885
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1886
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1888
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1889
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1890
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1891
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1893
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1894
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1895
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1896
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1898
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1899
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1900
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1901
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1903
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1904
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1905
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1906
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1907
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1908
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1909
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1910
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1911
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1912
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1913
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1914
+ "child": "DensityOfBulkMaterial"
1915
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1916
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1917
+ "ID": "TR_067a0b68",
1918
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1919
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1920
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1921
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1922
+ "ID": "TR_de5c2acc",
1923
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1924
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1925
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1926
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1928
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1929
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1930
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1931
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1932
+ "ID": "TR_4d4edd99",
1933
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1934
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1935
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1936
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1938
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1939
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1940
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1941
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1943
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1944
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1945
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1946
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1947
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1949
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1950
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1951
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1952
+ "ID": "TR_5cafdd62",
1953
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1954
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1955
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1956
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1957
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1958
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1959
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1960
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1961
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1962
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1963
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1964
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1965
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1966
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1967
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1968
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1969
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1971
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1972
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1973
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1974
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1976
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1977
+ "ID": "TR_8e641043",
1978
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1979
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1981
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1983
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1984
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1985
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1986
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1987
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1989
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1990
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1991
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1992
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1994
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1995
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1996
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+ "ID": "TR_5f4a630c",
1998
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1999
+ "child": "ThermalConductivityInPowderBed"
2000
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2001
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2002
+ "ID": "TR_6e839ce3",
2003
+ "parent": "ModelVariable",
2004
+ "child": "ThermalConductivityInPowderBed"
2005
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2006
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2007
+ "ID": "TR_41a52eb7",
2008
+ "parent": "RadiationTransferProperty",
2009
+ "child": "ThermalConductivityInPowderBed"
2010
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2011
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2012
+ "ID": "TR_fbff9e18",
2013
+ "parent": "TransportPropertyAssumption",
2014
+ "child": "ThermalConductivityInPowderBed"
2015
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2016
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+ "ID": "TR_87867ce0",
2018
+ "parent": "HeatDissipationCharacteristic",
2019
+ "child": "ThermalConductivityInPowderBed"
2020
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2021
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2023
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2024
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2025
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2026
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2028
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2029
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2030
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2031
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2032
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2033
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2034
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2035
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2036
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2038
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2039
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2040
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2041
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2042
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2043
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2044
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2045
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2046
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2048
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2049
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2050
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+ "ID": "TR_a8fc0a64",
3253
+ "parent": "Equation",
3254
+ "child": "RayTracingModel"
3255
+ },
3256
+ {
3257
+ "ID": "TR_6f37f673",
3258
+ "parent": "Equation",
3259
+ "child": "RayTracingModel"
3260
+ },
3261
+ {
3262
+ "ID": "TR_1b482d7b",
3263
+ "parent": "Equation",
3264
+ "child": "RayTracingModel"
3265
+ },
3266
+ {
3267
+ "ID": "TR_82fcf5db",
3268
+ "parent": "ProcessSignature",
3269
+ "child": "ResidualStressDistribution"
3270
+ },
3271
+ {
3272
+ "ID": "TR_dd96d73d",
3273
+ "parent": "SolidMechanicsModelPrediction",
3274
+ "child": "ResidualStressDistribution"
3275
+ },
3276
+ {
3277
+ "ID": "TR_bba4cd49",
3278
+ "parent": "SolidMechanicsModelPrediction",
3279
+ "child": "StrainDistribution"
3280
+ },
3281
+ {
3282
+ "ID": "TR_57645c13",
3283
+ "parent": "ProcessSignature",
3284
+ "child": "ResidualStressDistribution"
3285
+ },
3286
+ {
3287
+ "ID": "TR_636bf929",
3288
+ "parent": "SolidMechanicsModelPrediction",
3289
+ "child": "ResidualStressDistribution"
3290
+ },
3291
+ {
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+ "ID": "TR_0f1d73b4",
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+ "parent": "ProcessSignature",
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+ "child": "ResidualStressDistribution"
3295
+ },
3296
+ {
3297
+ "ID": "TR_eea0d24f",
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+ "parent": "SolidMechanicsModelPrediction",
3299
+ "child": "ResidualStressDistribution"
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+ },
3301
+ {
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+ "ID": "TR_04ed5675",
3303
+ "parent": "ProcessSignature",
3304
+ "child": "ResidualStressDistribution"
3305
+ },
3306
+ {
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+ "ID": "TR_9a6b25a4",
3308
+ "parent": "SolidMechanicsModelPrediction",
3309
+ "child": "ResidualStressDistribution"
3310
+ },
3311
+ {
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+ "ID": "TR_b1fd299e",
3313
+ "parent": "ProcessSignature",
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+ "child": "ResidualStressDistribution"
3315
+ },
3316
+ {
3317
+ "ID": "TR_3a92e195",
3318
+ "parent": "SolidMechanicsModelPrediction",
3319
+ "child": "ResidualStressDistribution"
3320
+ },
3321
+ {
3322
+ "ID": "TR_6169248d",
3323
+ "parent": "ProcessSignature",
3324
+ "child": "Shrinkage"
3325
+ },
3326
+ {
3327
+ "ID": "TR_df64e757",
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+ "parent": "ProcessSignature",
3329
+ "child": "Shrinkage"
3330
+ },
3331
+ {
3332
+ "ID": "TR_45423563",
3333
+ "parent": "StructuralPhenomenon",
3334
+ "child": "SolidMechanics"
3335
+ },
3336
+ {
3337
+ "ID": "TR_5b185eda",
3338
+ "parent": "HeatTransferProperty",
3339
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3340
+ },
3341
+ {
3342
+ "ID": "TR_d423f278",
3343
+ "parent": "DimensionalityOfAbsorbedHeat",
3344
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3345
+ },
3346
+ {
3347
+ "ID": "TR_84a257e0",
3348
+ "parent": "IrradiationAbsorptionModelPrediction",
3349
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3350
+ },
3351
+ {
3352
+ "ID": "TR_ecbf3fa3",
3353
+ "parent": "HeatTransferProperty",
3354
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3355
+ },
3356
+ {
3357
+ "ID": "TR_9f6496cb",
3358
+ "parent": "DimensionalityOfAbsorbedHeat",
3359
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3360
+ },
3361
+ {
3362
+ "ID": "TR_d5ec2d7a",
3363
+ "parent": "IrradiationAbsorptionModelPrediction",
3364
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3365
+ },
3366
+ {
3367
+ "ID": "TR_b26470c8",
3368
+ "parent": "HeatTransferProperty",
3369
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3370
+ },
3371
+ {
3372
+ "ID": "TR_2bd1868a",
3373
+ "parent": "DimensionalityOfAbsorbedHeat",
3374
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3375
+ },
3376
+ {
3377
+ "ID": "TR_f7a700f2",
3378
+ "parent": "IrradiationAbsorptionModelPrediction",
3379
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3380
+ },
3381
+ {
3382
+ "ID": "TR_4df70efa",
3383
+ "parent": "HeatTransferProperty",
3384
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3385
+ },
3386
+ {
3387
+ "ID": "TR_ec08c496",
3388
+ "parent": "DimensionalityOfAbsorbedHeat",
3389
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3390
+ },
3391
+ {
3392
+ "ID": "TR_1c9f3c1c",
3393
+ "parent": "IrradiationAbsorptionModelPrediction",
3394
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3395
+ },
3396
+ {
3397
+ "ID": "TR_b82a9e59",
3398
+ "parent": "HeatTransferProperty",
3399
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3400
+ },
3401
+ {
3402
+ "ID": "TR_9ff967c7",
3403
+ "parent": "DimensionalityOfAbsorbedHeat",
3404
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3405
+ },
3406
+ {
3407
+ "ID": "TR_58ead133",
3408
+ "parent": "IrradiationAbsorptionModelPrediction",
3409
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3410
+ },
3411
+ {
3412
+ "ID": "TR_f1150d48",
3413
+ "parent": "HeatTransferProperty",
3414
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3415
+ },
3416
+ {
3417
+ "ID": "TR_d990eaf2",
3418
+ "parent": "DimensionalityOfAbsorbedHeat",
3419
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3420
+ },
3421
+ {
3422
+ "ID": "TR_8ec1c13c",
3423
+ "parent": "IrradiationAbsorptionModelPrediction",
3424
+ "child": "SurfaceDistributionOfAbsorbedHeat"
3425
+ },
3426
+ {
3427
+ "ID": "TR_5cafba87",
3428
+ "parent": "PhysicalReflectionProperty",
3429
+ "child": "SurfaceDistributionOfHeat"
3430
+ },
3431
+ {
3432
+ "ID": "TR_13b84e86",
3433
+ "parent": "RadiationTransferProperty",
3434
+ "child": "SurfaceDistributionOfHeat"
3435
+ },
3436
+ {
3437
+ "ID": "TR_6e4d0255",
3438
+ "parent": "IrradiationModelingAssumption",
3439
+ "child": "SurfaceDistributionOfHeat"
3440
+ },
3441
+ {
3442
+ "ID": "TR_9d8368e3",
3443
+ "parent": "PhysicalReflectionProperty",
3444
+ "child": "SurfaceDistributionOfHeat"
3445
+ },
3446
+ {
3447
+ "ID": "TR_3a499857",
3448
+ "parent": "RadiationTransferProperty",
3449
+ "child": "SurfaceDistributionOfHeat"
3450
+ },
3451
+ {
3452
+ "ID": "TR_1c604ac3",
3453
+ "parent": "IrradiationModelingAssumption",
3454
+ "child": "SurfaceDistributionOfHeat"
3455
+ },
3456
+ {
3457
+ "ID": "TR_f8c7cee6",
3458
+ "parent": "DimensionalityOfPhysicalSystem",
3459
+ "child": "ThreeDimensional"
3460
+ },
3461
+ {
3462
+ "ID": "TR_feb551e9",
3463
+ "parent": "DimensionalityOfPhysicalSystem",
3464
+ "child": "TwoDimensional"
3465
+ },
3466
+ {
3467
+ "ID": "TR_5a61d1dc",
3468
+ "parent": "HeatTransferModelPrediction",
3469
+ "child": "TimeHistoryOfEnthalpy"
3470
+ },
3471
+ {
3472
+ "ID": "TR_9b69b145",
3473
+ "parent": "HeatTransferModelPrediction",
3474
+ "child": "TimeHistoryOfTemperature"
3475
+ },
3476
+ {
3477
+ "ID": "TR_ef7ac24e",
3478
+ "parent": "ProcessSignature",
3479
+ "child": "Void"
3480
+ },
3481
+ {
3482
+ "ID": "TR_2208bd3c",
3483
+ "parent": "ProcessSignature",
3484
+ "child": "Void"
3485
+ },
3486
+ {
3487
+ "ID": "TR_6d615f4e",
3488
+ "parent": "HeatTransferProperty",
3489
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3490
+ },
3491
+ {
3492
+ "ID": "TR_13177200",
3493
+ "parent": "DimensionalityOfAbsorbedHeat",
3494
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3495
+ },
3496
+ {
3497
+ "ID": "TR_dcf65fc3",
3498
+ "parent": "IrradiationAbsorptionModelPrediction",
3499
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3500
+ },
3501
+ {
3502
+ "ID": "TR_9bc50ee6",
3503
+ "parent": "HeatTransferProperty",
3504
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3505
+ },
3506
+ {
3507
+ "ID": "TR_c6419acd",
3508
+ "parent": "DimensionalityOfAbsorbedHeat",
3509
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3510
+ },
3511
+ {
3512
+ "ID": "TR_42a1e280",
3513
+ "parent": "IrradiationAbsorptionModelPrediction",
3514
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3515
+ },
3516
+ {
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+ "ID": "TR_6efa624a",
3518
+ "parent": "HeatTransferProperty",
3519
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3520
+ },
3521
+ {
3522
+ "ID": "TR_4d238033",
3523
+ "parent": "DimensionalityOfAbsorbedHeat",
3524
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3525
+ },
3526
+ {
3527
+ "ID": "TR_dde9a0c0",
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+ "parent": "IrradiationAbsorptionModelPrediction",
3529
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3530
+ },
3531
+ {
3532
+ "ID": "TR_556deb89",
3533
+ "parent": "HeatTransferProperty",
3534
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3535
+ },
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+ {
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+ "ID": "TR_4ce8dd5f",
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+ "parent": "DimensionalityOfAbsorbedHeat",
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+ "child": "VolumetricDistributionOfAbsorbedHeat"
3540
+ },
3541
+ {
3542
+ "ID": "TR_b077ca29",
3543
+ "parent": "IrradiationAbsorptionModelPrediction",
3544
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3545
+ },
3546
+ {
3547
+ "ID": "TR_62c0a6fa",
3548
+ "parent": "HeatTransferProperty",
3549
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3550
+ },
3551
+ {
3552
+ "ID": "TR_978b4836",
3553
+ "parent": "DimensionalityOfAbsorbedHeat",
3554
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3555
+ },
3556
+ {
3557
+ "ID": "TR_b6673488",
3558
+ "parent": "IrradiationAbsorptionModelPrediction",
3559
+ "child": "VolumetricDistributionOfAbsorbedHeat"
3560
+ }
3561
+ ]
3562
+ }
asmo/asmo.owl ADDED
The diff for this file is too large to render. See raw diff
 
asmo/asmo.rst ADDED
@@ -0,0 +1,70 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Atomistic Simulation Methods Ontology (ASMO)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ ASMO is an ontology that aims to define the concepts needed to describe commonly
7
+ used atomic scale simulation methods, i.e. density functional theory, molecular dynamics,
8
+ Monte Carlo methods, etc. ASMO uses the Provenance Ontology (PROV-O) to describe the simulation process.
9
+
10
+ :Domain: Materials Science and Engineering
11
+ :Category: Materials Science
12
+ :Current Version: 1.0.0
13
+ :Last Updated: None
14
+ :Creator: https://orcid.org/0000-0001-7564-7990
15
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
16
+ :Format: OWL
17
+ :Download: `Atomistic Simulation Methods Ontology (ASMO) Homepage <https://github.com/OCDO/asmo?tab=readme-ov-file#atomistic-simulation-methods-ontology-asmo>`_
18
+
19
+ Graph Metrics
20
+ -------------
21
+ - **Total Nodes**: 588
22
+ - **Total Edges**: 1058
23
+ - **Root Nodes**: 23
24
+ - **Leaf Nodes**: 360
25
+
26
+ Knowledge coverage
27
+ ------------------
28
+ - Classes: 99
29
+ - Individuals: 30
30
+ - Properties: 41
31
+
32
+ Hierarchical metrics
33
+ --------------------
34
+ - **Maximum Depth**: 5
35
+ - **Minimum Depth**: 0
36
+ - **Average Depth**: 1.71
37
+ - **Depth Variance**: 1.87
38
+
39
+ Breadth metrics
40
+ ------------------
41
+ - **Maximum Breadth**: 27
42
+ - **Minimum Breadth**: 3
43
+ - **Average Breadth**: 15.17
44
+ - **Breadth Variance**: 70.14
45
+
46
+ Dataset Statistics
47
+ ------------------
48
+ Generated Benchmarks:
49
+ - **Term Types**: 30
50
+ - **Taxonomic Relations**: 99
51
+ - **Non-taxonomic Relations**: 2
52
+ - **Average Terms per Type**: 3.75
53
+
54
+ Usage Example
55
+ -------------
56
+ .. code-block:: python
57
+
58
+ from ontolearner.ontology import ASMO
59
+
60
+ # Initialize and load ontology
61
+ ontology = ASMO()
62
+ ontology.load("path/to/ontology.OWL")
63
+
64
+ # Extract datasets
65
+ data = ontology.extract()
66
+
67
+ # Access specific relations
68
+ term_types = data.term_typings
69
+ taxonomic_relations = data.type_taxonomies
70
+ non_taxonomic_relations = data.type_non_taxonomic_relations
asmo/term_typings.json ADDED
@@ -0,0 +1,212 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ [
2
+ {
3
+ "ID": "TT_3c085274",
4
+ "term": "Third-order polynomial fit",
5
+ "types": [
6
+ "Equation of State Fit"
7
+ ]
8
+ },
9
+ {
10
+ "ID": "TT_de390bad",
11
+ "term": "Vinet",
12
+ "types": [
13
+ "Equation of State Fit"
14
+ ]
15
+ },
16
+ {
17
+ "ID": "TT_44f51bf0",
18
+ "term": "Birch-Murnaghan",
19
+ "types": [
20
+ "Equation of State Fit"
21
+ ]
22
+ },
23
+ {
24
+ "ID": "TT_b8cce995",
25
+ "term": "Murnaghan",
26
+ "types": [
27
+ "Equation of State Fit"
28
+ ]
29
+ },
30
+ {
31
+ "ID": "TT_f8661efc",
32
+ "term": "Parrinello-Rahman",
33
+ "types": [
34
+ "Barostat"
35
+ ]
36
+ },
37
+ {
38
+ "ID": "TT_f0d60806",
39
+ "term": "Berendsen Barostat",
40
+ "types": [
41
+ "Barostat"
42
+ ]
43
+ },
44
+ {
45
+ "ID": "TT_197aa60d",
46
+ "term": "Andersen Barostat",
47
+ "types": [
48
+ "Barostat"
49
+ ]
50
+ },
51
+ {
52
+ "ID": "TT_9e67bbf7",
53
+ "term": "Langevin",
54
+ "types": [
55
+ "Thermostat"
56
+ ]
57
+ },
58
+ {
59
+ "ID": "TT_c54b0d56",
60
+ "term": "Andersen Thermostat",
61
+ "types": [
62
+ "Thermostat"
63
+ ]
64
+ },
65
+ {
66
+ "ID": "TT_65f7acbe",
67
+ "term": "Berendsen Thermostat",
68
+ "types": [
69
+ "Thermostat"
70
+ ]
71
+ },
72
+ {
73
+ "ID": "TT_5867e1f8",
74
+ "term": "Bussi-Donadio-Parrinello",
75
+ "types": [
76
+ "Thermostat"
77
+ ]
78
+ },
79
+ {
80
+ "ID": "TT_0eb753c1",
81
+ "term": "Nose-Hoover",
82
+ "types": [
83
+ "Thermostat"
84
+ ]
85
+ },
86
+ {
87
+ "ID": "TT_ee6af87d",
88
+ "term": "Velocity Rescaling",
89
+ "types": [
90
+ "Thermostat"
91
+ ]
92
+ },
93
+ {
94
+ "ID": "TT_5f9893e7",
95
+ "term": "Isoenthalpic–Isobaric Ensemble",
96
+ "types": [
97
+ "Statistical Ensemble"
98
+ ]
99
+ },
100
+ {
101
+ "ID": "TT_be208d2e",
102
+ "term": "Grand Canonical Ensemble",
103
+ "types": [
104
+ "Statistical Ensemble"
105
+ ]
106
+ },
107
+ {
108
+ "ID": "TT_b5325ca6",
109
+ "term": "Isothermal–Isobaric Ensemble",
110
+ "types": [
111
+ "Statistical Ensemble"
112
+ ]
113
+ },
114
+ {
115
+ "ID": "TT_5d0f65db",
116
+ "term": "Canonical Ensemble",
117
+ "types": [
118
+ "Statistical Ensemble"
119
+ ]
120
+ },
121
+ {
122
+ "ID": "TT_0f3d237f",
123
+ "term": "Microcanonical Ensemble",
124
+ "types": [
125
+ "Statistical Ensemble"
126
+ ]
127
+ },
128
+ {
129
+ "ID": "TT_fda2394c",
130
+ "term": "Periodicity in Y-direction",
131
+ "types": [
132
+ "Periodic Boundary Condition"
133
+ ]
134
+ },
135
+ {
136
+ "ID": "TT_bcf42522",
137
+ "term": "Periodicity in Z-direction",
138
+ "types": [
139
+ "Periodic Boundary Condition"
140
+ ]
141
+ },
142
+ {
143
+ "ID": "TT_35721f97",
144
+ "term": "Periodicity in X-direction",
145
+ "types": [
146
+ "Periodic Boundary Condition"
147
+ ]
148
+ },
149
+ {
150
+ "ID": "TT_b140e4b6",
151
+ "term": "Explicit KPoint Mesh",
152
+ "types": [
153
+ "KPoint Mesh"
154
+ ]
155
+ },
156
+ {
157
+ "ID": "TT_58ee1eec",
158
+ "term": "Monkhorst Pack KPoint Mesh",
159
+ "types": [
160
+ "KPoint Mesh"
161
+ ]
162
+ },
163
+ {
164
+ "ID": "TT_d691ee6d",
165
+ "term": "Gamma-Centered KPoint Mesh",
166
+ "types": [
167
+ "KPoint Mesh"
168
+ ]
169
+ },
170
+ {
171
+ "ID": "TT_6c80e847",
172
+ "term": "Substitute Atom",
173
+ "types": [
174
+ "Point Defect Creation"
175
+ ]
176
+ },
177
+ {
178
+ "ID": "TT_4b314f89",
179
+ "term": "Delete Atom",
180
+ "types": [
181
+ "Point Defect Creation"
182
+ ]
183
+ },
184
+ {
185
+ "ID": "TT_dcb77559",
186
+ "term": "Add Atom",
187
+ "types": [
188
+ "Point Defect Creation"
189
+ ]
190
+ },
191
+ {
192
+ "ID": "TT_f800f689",
193
+ "term": "Cell Shape Relaxation",
194
+ "types": [
195
+ "Relaxation Degrees of Freedom"
196
+ ]
197
+ },
198
+ {
199
+ "ID": "TT_5b3288ff",
200
+ "term": "Cell Volume Relaxation",
201
+ "types": [
202
+ "Relaxation Degrees of Freedom"
203
+ ]
204
+ },
205
+ {
206
+ "ID": "TT_be911261",
207
+ "term": "Atomic Position Relaxation",
208
+ "types": [
209
+ "Relaxation Degrees of Freedom"
210
+ ]
211
+ }
212
+ ]
asmo/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,26 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "Activity",
4
+ "Entity",
5
+ "Molecular Dynamics",
6
+ "Molecular Statics"
7
+ ],
8
+ "relations": [
9
+ "disjointWith",
10
+ "seeAlso"
11
+ ],
12
+ "non_taxonomies": [
13
+ {
14
+ "ID": "NR_4fa89b96",
15
+ "head": "Molecular Statics",
16
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atomistic/atomistic.rst ADDED
@@ -0,0 +1,68 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Atomistic Ontology (Atomistic)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ An EMMO-based domain ontology for atomistic and electronic modelling.
7
+
8
+ :Domain: Materials Science and Engineering
9
+ :Category: Materials Science
10
+ :Current Version: 0.0.2
11
+ :Last Updated: None
12
+ :Creator: Francesca L. Bleken, Jesper Friis
13
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
14
+ :Format: TTL
15
+ :Download: `Atomistic Ontology (Atomistic) Homepage <https://github.com/emmo-repo/domain-atomistic>`_
16
+
17
+ Graph Metrics
18
+ -------------
19
+ - **Total Nodes**: 93
20
+ - **Total Edges**: 107
21
+ - **Root Nodes**: 11
22
+ - **Leaf Nodes**: 70
23
+
24
+ Knowledge coverage
25
+ ------------------
26
+ - Classes: 12
27
+ - Individuals: 0
28
+ - Properties: 2
29
+
30
+ Hierarchical metrics
31
+ --------------------
32
+ - **Maximum Depth**: 6
33
+ - **Minimum Depth**: 0
34
+ - **Average Depth**: 1.80
35
+ - **Depth Variance**: 2.27
36
+
37
+ Breadth metrics
38
+ ------------------
39
+ - **Maximum Breadth**: 44
40
+ - **Minimum Breadth**: 3
41
+ - **Average Breadth**: 13.29
42
+ - **Breadth Variance**: 182.78
43
+
44
+ Dataset Statistics
45
+ ------------------
46
+ Generated Benchmarks:
47
+ - **Term Types**: 0
48
+ - **Taxonomic Relations**: 0
49
+ - **Non-taxonomic Relations**: 0
50
+ - **Average Terms per Type**: 0.00
51
+
52
+ Usage Example
53
+ -------------
54
+ .. code-block:: python
55
+
56
+ from ontolearner.ontology import Atomistic
57
+
58
+ # Initialize and load ontology
59
+ ontology = Atomistic()
60
+ ontology.load("path/to/ontology.TTL")
61
+
62
+ # Extract datasets
63
+ data = ontology.extract()
64
+
65
+ # Access specific relations
66
+ term_types = data.term_typings
67
+ taxonomic_relations = data.type_taxonomies
68
+ non_taxonomic_relations = data.type_non_taxonomic_relations
atomistic/atomistic.ttl ADDED
@@ -0,0 +1,203 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ @prefix : <https://w3id.org/emmo/domain/atomistic#> .
2
+ @prefix owl: <http://www.w3.org/2002/07/owl#> .
3
+ @prefix rdf: <http://www.w3.org/1999/02/22-rdf-syntax-ns#> .
4
+ @prefix xml: <http://www.w3.org/XML/1998/namespace> .
5
+ @prefix xsd: <http://www.w3.org/2001/XMLSchema#> .
6
+ @prefix core: <http://www.w3.org/2004/02/skos/core#> .
7
+ @prefix emmo: <http://emmo.info/emmo#> .
8
+ @prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
9
+ @prefix term: <http://purl.org/dc/terms/> .
10
+ @base <https://w3id.org/emmo/domain/atomistic#> .
11
+
12
+ <https://w3id.org/emmo/domain/atomistic> rdf:type owl:Ontology ;
13
+ owl:versionIRI <https://w3id.org/emmo/domain/atomistic/0.0.2> ;
14
+ owl:imports <https://w3id.org/emmo/1.0.0/> ;
15
+ term:abstract "An EMMO-based domain ontology for atomistic and electronic modelling.Atomistic is released under the Creative Commons Attribution 4.0 International license (CC BY 4.0)."@en ;
16
+ term:contributor "SINTEF"@en ;
17
+ term:creator "Francesca L. Bleken"@en ,
18
+ "Jesper Friis"@en ;
19
+ term:publisher "EMMC ASBL"@en ;
20
+ term:title "Atomistic"@en ;
21
+ rdfs:comment """Contacts:
22
+ Jesper Friis
23
+ SINTEF
24
25
+
26
+ Francesca L. Bleken
27
+ SINTEF
28
+ email: [email protected]"""@en ,
29
+ "The EMMO requires FaCT++ reasoner plugin in order to visualize allinferences and class hierarchy (ctrl+R hotkey in Protege)."@en ,
30
+ "This ontology is generated with data from the ASE Python package."@en ;
31
+ owl:versionInfo "0.0.1"@en ;
32
+ <https://w3id.org/emmo#EMMO_5525a055_dda5_4556_8b91_f0d22fa676cc> "https://creativecommons.org/licenses/by/4.0/legalcode"@en .
33
+
34
+ #################################################################
35
+ # Annotation properties
36
+ #################################################################
37
+
38
+ ### https://w3id.org/emmo#EMMO_21ae69b4_235e_479d_8dd8_4f756f694c1b
39
+ <https://w3id.org/emmo#EMMO_21ae69b4_235e_479d_8dd8_4f756f694c1b> rdf:type owl:AnnotationProperty .
40
+
41
+
42
+ ### https://w3id.org/emmo#EMMO_5525a055_dda5_4556_8b91_f0d22fa676cc
43
+ <https://w3id.org/emmo#EMMO_5525a055_dda5_4556_8b91_f0d22fa676cc> rdf:type owl:AnnotationProperty .
44
+
45
+
46
+ ### https://w3id.org/emmo#EMMO_de178b12_5d35_4bca_8efa_a4193162571d
47
+ <https://w3id.org/emmo#EMMO_de178b12_5d35_4bca_8efa_a4193162571d> rdf:type owl:AnnotationProperty .
48
+
49
+
50
+ #################################################################
51
+ # Object Properties
52
+ #################################################################
53
+
54
+ ### https://w3id.org/emmo/domain/atomistic#EMMO_c2da4973_b83d_4581_a4b4_87ab401b8f5b
55
+ :EMMO_c2da4973_b83d_4581_a4b4_87ab401b8f5b rdf:type owl:ObjectProperty ;
56
+ rdfs:subPropertyOf <https://w3id.org/emmo#EMMO_8e52c42b_e879_4473_9fa1_4b23428b392b> ;
57
+ rdfs:domain <https://w3id.org/emmo#EMMO_a96e2152_40e7_409c_a53a_fdb9f141eb6a> ;
58
+ rdfs:range <https://w3id.org/emmo#EMMO_21205421_5783_4d3e_81e5_10c5d894a88a> ;
59
+ core:prefLabel "hasSpecies"@en ;
60
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "Relates a material to the species it is made of."@en ;
61
+ <https://w3id.org/emmo#EMMO_c7b62dd7_063a_4c2a_8504_42f7264ba83f> "Intended for documeting what kind of atoms a material is made of."@en .
62
+
63
+
64
+ ### https://w3id.org/emmo/domain/atomistic#42812fef-145a-56e9-9c18-72bd32214455
65
+ <https://w3id.org/emmo/domain/atomistic#42812fef-145a-56e9-9c18-72bd32214455> rdf:type owl:ObjectProperty ;
66
+ rdfs:subPropertyOf <https://w3id.org/emmo#EMMO_e1097637_70d2_4895_973f_2396f04fa204> ;
67
+ rdfs:domain <https://w3id.org/emmo#EMMO_f6d0c26a_98b6_4cf8_8632_aa259131faaa> ;
68
+ core:prefLabel "hasEigenvalue"@en ;
69
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "Relates a mathematical (or physical) operator to its eigenvalue."@en .
70
+
71
+
72
+ #################################################################
73
+ # Classes
74
+ #################################################################
75
+
76
+ ### https://w3id.org/emmo/domain/atomistic#EMMO_070efd9c_b971_44ee_bd45_8c548a80a65d
77
+ :EMMO_070efd9c_b971_44ee_bd45_8c548a80a65d rdf:type owl:Class ;
78
+ rdfs:subClassOf :EMMO_3cd827b2_e9c6_4d08_a215_d22fd2a46298 ;
79
+ core:example "LAMMPS"@en ;
80
+ core:prefLabel "ForceFieldSimulationSoftware"@en ;
81
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "Forcefield-based simulation software."@en .
82
+
83
+
84
+ ### https://w3id.org/emmo/domain/atomistic#EMMO_3cd827b2_e9c6_4d08_a215_d22fd2a46298
85
+ :EMMO_3cd827b2_e9c6_4d08_a215_d22fd2a46298 rdf:type owl:Class ;
86
+ rdfs:subClassOf <https://w3id.org/emmo#EMMO_8d4962d7_9608_44f7_a2f1_82a4bb173f4a> ;
87
+ core:example "NWChem - a physical based software that implements both DFT and higher order QM methods."@en ;
88
+ core:prefLabel "AtomisticSimulationSoftware"@en ;
89
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "The superclass of physical-based electronic and forcefield simulation softwares."@en .
90
+
91
+
92
+ ### https://w3id.org/emmo/domain/atomistic#EMMO_429430f4_00e9_4157_a636_6cf798139e40
93
+ :EMMO_429430f4_00e9_4157_a636_6cf798139e40 rdf:type owl:Class ;
94
+ rdfs:subClassOf :EMMO_3cd827b2_e9c6_4d08_a215_d22fd2a46298 ;
95
+ core:example "VASP, Quantum ESPRESSO, NWChem "@en ;
96
+ core:prefLabel "DFTSimulationSoftware"@en ;
97
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "DFT-based simulation software."@en .
98
+
99
+
100
+ ### https://w3id.org/emmo/domain/atomistic#EMMO_52a6103f_86a4_4710_9028_a49b4cef858e
101
+ :EMMO_52a6103f_86a4_4710_9028_a49b4cef858e rdf:type owl:Class ;
102
+ rdfs:subClassOf <https://w3id.org/emmo#EMMO_5dd63d84_57f5_4b79_b760_fe940c06680d> ;
103
+ core:prefLabel "DFTComputation"@en ;
104
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "A computation that solves the Kohn-Sham equation (using DFT)."@en .
105
+
106
+
107
+ ### https://w3id.org/emmo/domain/atomistic#acaafcb6-b65f-5996-93ed-2f486f5f2b30
108
+ :acaafcb6-b65f-5996-93ed-2f486f5f2b30 rdf:type owl:Class ;
109
+ rdfs:subClassOf :c4dd4450-cc80-5de4-a8d6-db0651115a2c ;
110
+ core:prefLabel "TimeIndependentSchrodingerEquation"@en ;
111
+ <https://w3id.org/emmo#EMMO_21ae69b4_235e_479d_8dd8_4f756f694c1b> "TimeIndependentSchrödingerEquation"@en ;
112
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> """If the external potential does not depende on time, the Schrödinger
113
+ equation can be reduced to this time-independent form."""@en .
114
+
115
+
116
+ ### https://w3id.org/emmo/domain/atomistic#b65fe3b6-8477-5508-a066-2f7edcf25126
117
+ :b65fe3b6-8477-5508-a066-2f7edcf25126 rdf:type owl:Class ;
118
+ rdfs:subClassOf :acaafcb6-b65f-5996-93ed-2f486f5f2b30 ,
119
+ [ rdf:type owl:Restriction ;
120
+ owl:onProperty <https://w3id.org/emmo#EMMO_b2282816_b7a3_44c6_b2cb_3feff1ceb7fe> ;
121
+ owl:someValuesFrom <https://w3id.org/emmo#EMMO_5cbb7bfb_7ab8_4151_8ed1_13a5b7d5caa4>
122
+ ] ;
123
+ rdfs:comment "This is the equation that is solved with density functional theory." ;
124
+ core:prefLabel "KohnShamEquation"@en ;
125
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "The Schrödinger equation for a fictious \"Kohn-Sham\" system of non-interacting electrons that generates the same charge density as the real interacting system."@en .
126
+
127
+
128
+ ### https://w3id.org/emmo/domain/atomistic#c4dd4450-cc80-5de4-a8d6-db0651115a2c
129
+ :c4dd4450-cc80-5de4-a8d6-db0651115a2c rdf:type owl:Class ;
130
+ rdfs:subClassOf <https://w3id.org/emmo#EMMO_27c5d8c6_8af7_4d63_beb1_ec37cd8b3fa3> ,
131
+ [ rdf:type owl:Restriction ;
132
+ owl:onProperty <https://w3id.org/emmo#EMMO_b2282816_b7a3_44c6_b2cb_3feff1ceb7fe> ;
133
+ owl:someValuesFrom <https://w3id.org/emmo#EMMO_31ec09ba_1713_42cb_83c7_b38bf6f9ced2>
134
+ ] ,
135
+ [ rdf:type owl:Restriction ;
136
+ owl:onProperty <https://w3id.org/emmo#EMMO_b2282816_b7a3_44c6_b2cb_3feff1ceb7fe> ;
137
+ owl:someValuesFrom :df750ce7-fda1-5e9b-ba32-db96ec170577
138
+ ] ,
139
+ [ rdf:type owl:Restriction ;
140
+ owl:onProperty <https://w3id.org/emmo#EMMO_b2282816_b7a3_44c6_b2cb_3feff1ceb7fe> ;
141
+ owl:someValuesFrom <https://w3id.org/emmo/domain/atomistic#42244404-98d1-582a-8fc0-3cdd2a9b3df6>
142
+ ] ;
143
+ core:prefLabel "SchrodingerEquation"@en ;
144
+ <https://w3id.org/emmo#EMMO_21ae69b4_235e_479d_8dd8_4f756f694c1b> "SchrödingerEquation"@en ;
145
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> """A linear partial differential equation describing the wave
146
+ function of a quantum-mechanical system.
147
+
148
+ The exact form of the Schrödinger equation depends on the
149
+ physical situation. The most general form is the
150
+ time-dependent Schrödinger equation."""@en ;
151
+ <https://w3id.org/emmo#EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d> "https://en.wikipedia.org/wiki/Schr%C3%B6dinger_equation" .
152
+
153
+
154
+ ### https://w3id.org/emmo/domain/atomistic#df750ce7-fda1-5e9b-ba32-db96ec170577
155
+ :df750ce7-fda1-5e9b-ba32-db96ec170577 rdf:type owl:Class ;
156
+ rdfs:subClassOf <https://w3id.org/emmo#EMMO_a66427d1_9932_4363_9ec5_7d91f2bfda1e> ;
157
+ core:prefLabel "WaveFunction"@en ;
158
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> """A mathematical description of the quantum state of an isolated
159
+ quantum system. A wave function is a function of the degrees
160
+ of freedom corresponding to some maximal set of commuting
161
+ observables. Once such a representation is chosen, the wave
162
+ function can be derived from the quantum state."""@en ;
163
+ <https://w3id.org/emmo#EMMO_c84c6752_6d64_48cc_9500_e54a3c34898d> "https://en.wikipedia.org/wiki/Wave_function" ;
164
+ <https://w3id.org/emmo#EMMO_de178b12_5d35_4bca_8efa_a4193162571d> "T0 L0 M0 I0 Θ0 N0 J0" .
165
+
166
+
167
+ ### https://w3id.org/emmo/domain/atomistic#fac61002-4a3d-5810-a430-ad5dad69c9a0
168
+ :fac61002-4a3d-5810-a430-ad5dad69c9a0 rdf:type owl:Class ;
169
+ rdfs:subClassOf :c4dd4450-cc80-5de4-a8d6-db0651115a2c ;
170
+ core:prefLabel "TimeDependentSchrodingerEquation"@en ;
171
+ <https://w3id.org/emmo#EMMO_21ae69b4_235e_479d_8dd8_4f756f694c1b> "TimeDependentSchrödingerEquation"@en ;
172
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "The full time-dependent Schrödinger equation."@en .
173
+
174
+
175
+ ### https://w3id.org/emmo/domain/atomistic#08fd7117-66ac-5b6d-b65e-34a826675877
176
+ <https://w3id.org/emmo/domain/atomistic#08fd7117-66ac-5b6d-b65e-34a826675877> rdf:type owl:Class ;
177
+ rdfs:subClassOf <https://w3id.org/emmo#EMMO_f6d0c26a_98b6_4cf8_8632_aa259131faaa> ;
178
+ core:prefLabel "PhysicalOperator"@en ;
179
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> "A mathematical operator with a physical interpretation."@en .
180
+
181
+
182
+ ### https://w3id.org/emmo/domain/atomistic#42244404-98d1-582a-8fc0-3cdd2a9b3df6
183
+ <https://w3id.org/emmo/domain/atomistic#42244404-98d1-582a-8fc0-3cdd2a9b3df6> rdf:type owl:Class ;
184
+ rdfs:subClassOf <https://w3id.org/emmo#EMMO_6f5af708_f825_4feb_a0d1_a8d813d3022b> ,
185
+ <https://w3id.org/emmo/domain/atomistic#08fd7117-66ac-5b6d-b65e-34a826675877> ,
186
+ [ rdf:type owl:Restriction ;
187
+ owl:onProperty <https://w3id.org/emmo/domain/atomistic#42812fef-145a-56e9-9c18-72bd32214455> ;
188
+ owl:someValuesFrom <https://w3id.org/emmo#EMMO_31ec09ba_1713_42cb_83c7_b38bf6f9ced2>
189
+ ] ;
190
+ core:prefLabel "Hamiltonian"@en ;
191
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> """An operator corresponding to the sum of the kinetic energies plus
192
+ the potential energies for all the particles in the system."""@en .
193
+
194
+
195
+ ### https://w3id.org/emmo/domain/atomistic#83a69cf2-00c1-58b8-915b-76cb3549890a
196
+ <https://w3id.org/emmo/domain/atomistic#83a69cf2-00c1-58b8-915b-76cb3549890a> rdf:type owl:Class ;
197
+ rdfs:subClassOf <https://w3id.org/emmo#EMMO_6eca09be_17e9_445e_abc9_000aa61b7a11> ;
198
+ core:prefLabel "DensityFunctionalTheory"@en ;
199
+ <https://w3id.org/emmo#EMMO_967080e5_2f42_4eb2_a3a9_c58143e835f9> """An efficient computional method for solving the many-electron
200
+ (time-independent) Schrödinger equation."""@en .
201
+
202
+
203
+ ### Generated by the OWL API (version 4.5.26.2023-07-17T20:34:13Z) https://github.com/owlcs/owlapi
atomistic/term_typings.json ADDED
@@ -0,0 +1 @@
 
 
1
+ []
atomistic/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,5 @@
 
 
 
 
 
 
1
+ {
2
+ "types": [],
3
+ "relations": [],
4
+ "non_taxonomies": []
5
+ }
atomistic/type_taxonomies.json ADDED
@@ -0,0 +1,4 @@
 
 
 
 
 
1
+ {
2
+ "types": [],
3
+ "taxonomies": []
4
+ }
battinfo/battinfo.rst ADDED
@@ -0,0 +1,71 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Battery Interface Ontology (BattINFO)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ BattINFO is a foundational resource for harmonizing battery knowledge representation
7
+ and enhancing data interoperability. The primary objective is to provide the necessary tools
8
+ to create FAIR (Findable, Accessible, Interoperable, Reusable) battery data
9
+ that can be integrated into the Semantic Web.
10
+
11
+ :Domain: Materials Science and Engineering
12
+ :Category: Materials Science
13
+ :Current Version: None
14
+ :Last Updated: None
15
+ :Creator: None
16
+ :License: None
17
+ :Format: TTL
18
+ :Download: `Battery Interface Ontology (BattINFO) Homepage <https://github.com/BIG-MAP/BattINFO>`_
19
+
20
+ Graph Metrics
21
+ -------------
22
+ - **Total Nodes**: 27319
23
+ - **Total Edges**: 50787
24
+ - **Root Nodes**: 2855
25
+ - **Leaf Nodes**: 16852
26
+
27
+ Knowledge coverage
28
+ ------------------
29
+ - Classes: 4431
30
+ - Individuals: 7
31
+ - Properties: 304
32
+
33
+ Hierarchical metrics
34
+ --------------------
35
+ - **Maximum Depth**: 27
36
+ - **Minimum Depth**: 0
37
+ - **Average Depth**: 2.09
38
+ - **Depth Variance**: 7.40
39
+
40
+ Breadth metrics
41
+ ------------------
42
+ - **Maximum Breadth**: 10695
43
+ - **Minimum Breadth**: 7
44
+ - **Average Breadth**: 827.86
45
+ - **Breadth Variance**: 4644992.84
46
+
47
+ Dataset Statistics
48
+ ------------------
49
+ Generated Benchmarks:
50
+ - **Term Types**: 10
51
+ - **Taxonomic Relations**: 195
52
+ - **Non-taxonomic Relations**: 2
53
+ - **Average Terms per Type**: 10.00
54
+
55
+ Usage Example
56
+ -------------
57
+ .. code-block:: python
58
+
59
+ from ontolearner.ontology import BattINFO
60
+
61
+ # Initialize and load ontology
62
+ ontology = BattINFO()
63
+ ontology.load("path/to/ontology.TTL")
64
+
65
+ # Extract datasets
66
+ data = ontology.extract()
67
+
68
+ # Access specific relations
69
+ term_types = data.term_typings
70
+ taxonomic_relations = data.type_taxonomies
71
+ non_taxonomic_relations = data.type_non_taxonomic_relations
battinfo/battinfo.ttl ADDED
@@ -0,0 +1,72 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ @prefix : <https://big-map.github.io/BattINFO/ontology/BattINFO#> .
2
+ @prefix owl: <http://www.w3.org/2002/07/owl#> .
3
+ @prefix rdf: <http://www.w3.org/1999/02/22-rdf-syntax-ns#> .
4
+ @prefix xml: <http://www.w3.org/XML/1998/namespace> .
5
+ @prefix xsd: <http://www.w3.org/2001/XMLSchema#> .
6
+ @prefix emmo: <https://w3id.org/emmo#> .
7
+ @prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
8
+ @prefix skos: <http://www.w3.org/2004/02/skos/core#> .
9
+ @prefix dcterms: <http://purl.org/dc/terms/> .
10
+ @prefix annotations: <https://w3id.org/emmo/top/annotations#> .
11
+ @prefix echem: <https://w3id.org/emmo/domain/electrochemistry#> .
12
+ @prefix batt: <https://w3id.org/emmo/domain/battery#> .
13
+ @base <https://w3id.org/battinfo> .
14
+
15
+ <https://w3id.org/battinfo> rdf:type owl:Ontology ;
16
+ owl:versionIRI <https://w3id.org/battinfo/0.8.0-beta/battinfo> ;
17
+ owl:imports <https://w3id.org/emmo/domain/battery/0.13.0-beta/battery> ;
18
+ dcterms:abstract """A battery interface domain ontology based on EMMO.
19
+ This file is intended to be empty and merely collecting the other ontologies.
20
+ Released under the Creative Commons license Attribution 4.0 International (CC BY 4.0)."""@en ;
21
+ dcterms:contributor "Anna Szczesna"@en ,
22
+ "Denmark Technical University (DTU), DK"@en ,
23
+ "Deyana Stoytcheva"@en ,
24
+ "EPFL, CH"@en ,
25
+ "Fraunhofer ISC, DE"@en ,
26
+ "ICMAB, ES"@en ,
27
+ "Marek Marcinek"@en ,
28
+ "Martin Uhrin"@en ,
29
+ "Miran Gaberscek"@en ,
30
+ "National Institute of Chemistry, SI"@en ,
31
+ "Rosa Palacin"@en ,
32
+ "Simon Stier"@en ,
33
+ "Warsaw University of Technology, PL"@en ;
34
+ dcterms:creator "Casper Welzel Andersen"@en ,
35
+ "Eibar Flores"@en ,
36
+ "Francesca Lønstad Bleken"@en ,
37
+ "Jesper Friis"@en ,
38
+ "SINTEF, NO"@en ,
39
+ "Simon Clark"@en ;
40
+ dcterms:license "https://creativecommons.org/licenses/by/4.0/legalcode" ;
41
+ dcterms:title "Battery Interface Ontology (BattINFO)"@en ;
42
+ rdfs:comment """Contacts:
43
+ Simon Clark
44
+ SINTEF Industry
45
+ email: [email protected]"""@en ;
46
+ owl:versionInfo "0.8.0" .
47
+
48
+ #################################################################
49
+ # Annotation properties
50
+ #################################################################
51
+
52
+ ### http://purl.org/dc/terms/abstract
53
+ dcterms:abstract rdf:type owl:AnnotationProperty .
54
+
55
+
56
+ ### http://purl.org/dc/terms/contributor
57
+ dcterms:contributor rdf:type owl:AnnotationProperty .
58
+
59
+
60
+ ### http://purl.org/dc/terms/creator
61
+ dcterms:creator rdf:type owl:AnnotationProperty .
62
+
63
+
64
+ ### http://purl.org/dc/terms/license
65
+ dcterms:license rdf:type owl:AnnotationProperty .
66
+
67
+
68
+ ### http://purl.org/dc/terms/title
69
+ dcterms:title rdf:type owl:AnnotationProperty .
70
+
71
+
72
+ ### Generated by the OWL API (version 4.5.9.2019-02-01T07:24:44Z) https://github.com/owlcs/owlapi
battinfo/term_typings.json ADDED
@@ -0,0 +1,72 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ [
2
+ {
3
+ "ID": "TT_65e319fb",
4
+ "term": "Jesper Friis",
5
+ "types": [
6
+ "Person"
7
+ ]
8
+ },
9
+ {
10
+ "ID": "TT_d3963e97",
11
+ "term": "Francesca Lønstad Bleken",
12
+ "types": [
13
+ "Person"
14
+ ]
15
+ },
16
+ {
17
+ "ID": "TT_cbe629ff",
18
+ "term": "Eibar Flores",
19
+ "types": [
20
+ "Person"
21
+ ]
22
+ },
23
+ {
24
+ "ID": "TT_a9e690ad",
25
+ "term": "Casper Welzel Andersen",
26
+ "types": [
27
+ "Person"
28
+ ]
29
+ },
30
+ {
31
+ "ID": "TT_c474022c",
32
+ "term": "Simon Clark",
33
+ "types": [
34
+ "Person"
35
+ ]
36
+ },
37
+ {
38
+ "ID": "TT_0b7d89ba",
39
+ "term": "Jesper Friis",
40
+ "types": [
41
+ "Person"
42
+ ]
43
+ },
44
+ {
45
+ "ID": "TT_af161cc3",
46
+ "term": "Francesca Lønstad Bleken",
47
+ "types": [
48
+ "Person"
49
+ ]
50
+ },
51
+ {
52
+ "ID": "TT_9e096c0d",
53
+ "term": "Eibar Flores",
54
+ "types": [
55
+ "Person"
56
+ ]
57
+ },
58
+ {
59
+ "ID": "TT_078020f9",
60
+ "term": "Casper Welzel Andersen",
61
+ "types": [
62
+ "Person"
63
+ ]
64
+ },
65
+ {
66
+ "ID": "TT_13aff92e",
67
+ "term": "Simon Clark",
68
+ "types": [
69
+ "Person"
70
+ ]
71
+ }
72
+ ]
battinfo/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,25 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "HardwareManufacturer",
4
+ "HardwareModel",
5
+ "PreparedSample",
6
+ "ReferenceSample"
7
+ ],
8
+ "relations": [
9
+ "disjointWith"
10
+ ],
11
+ "non_taxonomies": [
12
+ {
13
+ "ID": "NR_9c7f9493",
14
+ "head": "PreparedSample",
15
+ "tail": "ReferenceSample",
16
+ "relation": "disjointWith"
17
+ },
18
+ {
19
+ "ID": "NR_ede3dc3f",
20
+ "head": "HardwareManufacturer",
21
+ "tail": "HardwareModel",
22
+ "relation": "disjointWith"
23
+ }
24
+ ]
25
+ }
battinfo/type_taxonomies.json ADDED
@@ -0,0 +1,1151 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "EnergyDispersiveXraySpectroscopy",
4
+ "SampleExtractionInstrument",
5
+ "LinearScanVoltammetry",
6
+ "CyclicChronopotentiometry",
7
+ "DeviceSample",
8
+ "ElectrochemicalTesting",
9
+ "UltrasonicTesting",
10
+ "HPPC",
11
+ "Signal",
12
+ "DataNormalisation",
13
+ "ICI",
14
+ "ACVoltammetry",
15
+ "FourierTransformInfraredSpectroscopy",
16
+ "SampledDCPolarography",
17
+ "ScanningProbeMicroscopy",
18
+ "SampleExtraction",
19
+ "WearTesting",
20
+ "ChargeDistribution",
21
+ "Exafs",
22
+ "DifferentialScanningCalorimetry",
23
+ "Chronocoulometry",
24
+ "Thermogravimetry",
25
+ "LinearChronopotentiometry",
26
+ "ThermochemicalTesting",
27
+ "AdsorptiveStrippingVoltammetry",
28
+ "SamplePreparationInstrument",
29
+ "StepChronopotentiometry",
30
+ "RawData",
31
+ "CharacterisationProcedure",
32
+ "GasAdsorptionPorosimetry",
33
+ "SquareWaveVoltammetry",
34
+ "Synchrotron",
35
+ "VaporPressureDepressionOsmometry",
36
+ "CathodicStrippingVoltammetry",
37
+ "FreezingPointDepressionOsmometry",
38
+ "BrunauerEmmettTellerMethod",
39
+ "DataPreparation",
40
+ "Conductometry",
41
+ "Osmometry",
42
+ "CriticalAndSupercriticalChromatography",
43
+ "AnodicStrippingVoltammetry",
44
+ "CyclicVoltammetry",
45
+ "Spectroscopy",
46
+ "Impedimetry",
47
+ "CompressionTesting",
48
+ "DynamicLightScattering",
49
+ "IntermediateSample",
50
+ "DifferentialStaircasePulseVoltammetry",
51
+ "RamanSpectroscopy",
52
+ "Viscometry",
53
+ "PseudoOpenCircuitVoltageMethod",
54
+ "Nanoindentation",
55
+ "SecondaryIonMassSpectrometry",
56
+ "DielectricAndImpedanceSpectroscopy",
57
+ "SecondaryData",
58
+ "OutlierRemoval",
59
+ "CharacterisationHardware",
60
+ "Ellipsometry",
61
+ "OpticalTesting",
62
+ "MechanicalTesting",
63
+ "StrippingVoltammetry",
64
+ "PhotoluminescenceMicroscopy",
65
+ "CalibrationData",
66
+ "SampleInspection",
67
+ "Chronoamperometry",
68
+ "CharacterisationMeasurementProcess",
69
+ "CharacterisationHardwareSpecification",
70
+ "MembraneOsmometry",
71
+ "Polishing",
72
+ "Holder",
73
+ "XrayPowderDiffraction",
74
+ "Microscopy",
75
+ "ElectrochemicalPiezoelectricMicrogravimetry",
76
+ "PulsedElectroacousticMethod",
77
+ "Chromatography",
78
+ "HardwareModel",
79
+ "Sample",
80
+ "ElectronBackscatterDiffraction",
81
+ "DirectCoulometryAtControlledPotential",
82
+ "ScanningKelvinProbe",
83
+ "GalvanostaticIntermittentTitrationTechnique",
84
+ "Spectrometry",
85
+ "IsothermalMicrocalorimetry",
86
+ "AlphaSpectrometry",
87
+ "PrimaryData",
88
+ "ElectrochemicalImpedanceSpectroscopy",
89
+ "ConfocalMicroscopy",
90
+ "SamplePreparation",
91
+ "Chronopotentiometry",
92
+ "ShearOrTorsionTesting",
93
+ "ScanningTunnelingMicroscopy",
94
+ "OpenCircuitHold",
95
+ "DCPolarography",
96
+ "DirectCurrentInternalResistance",
97
+ "IonMobilitySpectrometry",
98
+ "ElectronProbeMicroanalysis",
99
+ "MassSpectrometry",
100
+ "CharacterisationTechnique",
101
+ "Coulometry",
102
+ "DynamicMechanicalSpectroscopy",
103
+ "HydrodynamicVoltammetry",
104
+ "Profilometry",
105
+ "DirectCoulometryAtControlledCurrent",
106
+ "Probe",
107
+ "MercuryPorosimetry",
108
+ "DifferentialLinearPulseVoltammetry",
109
+ "DataFiltering",
110
+ "DynamicMechanicalAnalysis",
111
+ "Potentiometry",
112
+ "MeasurementSystemAdjustment",
113
+ "DifferentialPulseVoltammetry",
114
+ "XrayDiffraction",
115
+ "Voltammetry",
116
+ "TransmissionElectronMicroscopy",
117
+ "CharacterisationProtocol",
118
+ "EnvironmentalScanningElectronMicroscopy",
119
+ "CharacterisedSample",
120
+ "FieldEmissionScanningElectronMicroscopy",
121
+ "CharacterisationMeasurementInstrument",
122
+ "HardnessTesting",
123
+ "ThreePointBendingTesting",
124
+ "AbrasiveStrippingVoltammetry",
125
+ "Dilatometry",
126
+ "Fractography",
127
+ "DifferentialThermalAnalysis",
128
+ "XrdGrazingIncidence",
129
+ "CharacterisationData",
130
+ "ScanningAugerElectronMicroscopy",
131
+ "FatigueTesting",
132
+ "PotentiometricStrippingAnalysis",
133
+ "AtomicForceMicroscopy",
134
+ "XpsVariableKinetic",
135
+ "Calorimetry",
136
+ "CreepTesting",
137
+ "LightScattering",
138
+ "SampleInspectionInstrument",
139
+ "DifferentialRefractiveIndex",
140
+ "Electrogravimetry",
141
+ "SamplePreparationByCutting",
142
+ "Dielectrometry",
143
+ "TensileTesting",
144
+ "UltravioletVisibleSpectroscopy",
145
+ "NormalPulseVoltammetry",
146
+ "RawSample",
147
+ "Nexafs",
148
+ "VoltammetryAtARotatingDiskElectrode",
149
+ "Amperometry",
150
+ "OpticalMicroscopy",
151
+ "Grinding",
152
+ "HardwareManufacturer",
153
+ "FibDic",
154
+ "Milling",
155
+ "NuclearMagneticResonance",
156
+ "ScanningElectronMicroscopy",
157
+ "CoulometricTitration",
158
+ "ConductometricTitration",
159
+ "ReferenceSample",
160
+ "AtomProbeTomography",
161
+ "Porosimetry",
162
+ "ScatteringAndDiffraction",
163
+ "CalibrationProcess",
164
+ "NeutronSpinEchoSpectroscopy",
165
+ "Mounting",
166
+ "SampleExtractionByCutting",
167
+ "Detector",
168
+ "GammaSpectrometry",
169
+ "AnalyticalElectronMicroscopy",
170
+ "Tomography",
171
+ "PreparedSample",
172
+ "IonChromatography"
173
+ ],
174
+ "taxonomies": [
175
+ {
176
+ "ID": "TR_24d7ecd0",
177
+ "parent": "CharacterisationData",
178
+ "child": "RawData"
179
+ },
180
+ {
181
+ "ID": "TR_146324d5",
182
+ "parent": "CharacterisationHardware",
183
+ "child": "CharacterisationMeasurementInstrument"
184
+ },
185
+ {
186
+ "ID": "TR_0af07655",
187
+ "parent": "CharacterisationProcedure",
188
+ "child": "CharacterisationMeasurementProcess"
189
+ },
190
+ {
191
+ "ID": "TR_ca115c3a",
192
+ "parent": "Sample",
193
+ "child": "DeviceSample"
194
+ },
195
+ {
196
+ "ID": "TR_b6b8653e",
197
+ "parent": "Voltammetry",
198
+ "child": "ACVoltammetry"
199
+ },
200
+ {
201
+ "ID": "TR_5ec77944",
202
+ "parent": "Voltammetry",
203
+ "child": "AbrasiveStrippingVoltammetry"
204
+ },
205
+ {
206
+ "ID": "TR_eb45a8a5",
207
+ "parent": "Voltammetry",
208
+ "child": "CyclicVoltammetry"
209
+ },
210
+ {
211
+ "ID": "TR_d6620278",
212
+ "parent": "Voltammetry",
213
+ "child": "DCPolarography"
214
+ },
215
+ {
216
+ "ID": "TR_be00ce0f",
217
+ "parent": "Voltammetry",
218
+ "child": "DifferentialPulseVoltammetry"
219
+ },
220
+ {
221
+ "ID": "TR_564c087f",
222
+ "parent": "Voltammetry",
223
+ "child": "HydrodynamicVoltammetry"
224
+ },
225
+ {
226
+ "ID": "TR_7432e506",
227
+ "parent": "Voltammetry",
228
+ "child": "LinearScanVoltammetry"
229
+ },
230
+ {
231
+ "ID": "TR_052fa4b0",
232
+ "parent": "Voltammetry",
233
+ "child": "NormalPulseVoltammetry"
234
+ },
235
+ {
236
+ "ID": "TR_acf5acac",
237
+ "parent": "Voltammetry",
238
+ "child": "PotentiometricStrippingAnalysis"
239
+ },
240
+ {
241
+ "ID": "TR_7c30f326",
242
+ "parent": "Voltammetry",
243
+ "child": "SquareWaveVoltammetry"
244
+ },
245
+ {
246
+ "ID": "TR_e7eb5c9b",
247
+ "parent": "Voltammetry",
248
+ "child": "StrippingVoltammetry"
249
+ },
250
+ {
251
+ "ID": "TR_72969dfe",
252
+ "parent": "StrippingVoltammetry",
253
+ "child": "AdsorptiveStrippingVoltammetry"
254
+ },
255
+ {
256
+ "ID": "TR_b36f6216",
257
+ "parent": "StrippingVoltammetry",
258
+ "child": "AnodicStrippingVoltammetry"
259
+ },
260
+ {
261
+ "ID": "TR_e20bf767",
262
+ "parent": "StrippingVoltammetry",
263
+ "child": "CathodicStrippingVoltammetry"
264
+ },
265
+ {
266
+ "ID": "TR_7e9084da",
267
+ "parent": "Spectrometry",
268
+ "child": "AlphaSpectrometry"
269
+ },
270
+ {
271
+ "ID": "TR_2c2f01c8",
272
+ "parent": "Spectrometry",
273
+ "child": "GammaSpectrometry"
274
+ },
275
+ {
276
+ "ID": "TR_7ab5ea26",
277
+ "parent": "Spectrometry",
278
+ "child": "IonMobilitySpectrometry"
279
+ },
280
+ {
281
+ "ID": "TR_7b820db6",
282
+ "parent": "Spectrometry",
283
+ "child": "MassSpectrometry"
284
+ },
285
+ {
286
+ "ID": "TR_cf858519",
287
+ "parent": "Spectrometry",
288
+ "child": "SecondaryIonMassSpectrometry"
289
+ },
290
+ {
291
+ "ID": "TR_78045549",
292
+ "parent": "ElectrochemicalTesting",
293
+ "child": "Amperometry"
294
+ },
295
+ {
296
+ "ID": "TR_ba747a75",
297
+ "parent": "ElectrochemicalTesting",
298
+ "child": "Conductometry"
299
+ },
300
+ {
301
+ "ID": "TR_6a8eea41",
302
+ "parent": "ElectrochemicalTesting",
303
+ "child": "Coulometry"
304
+ },
305
+ {
306
+ "ID": "TR_58bdedab",
307
+ "parent": "ElectrochemicalTesting",
308
+ "child": "Dielectrometry"
309
+ },
310
+ {
311
+ "ID": "TR_267bc54d",
312
+ "parent": "ElectrochemicalTesting",
313
+ "child": "Electrogravimetry"
314
+ },
315
+ {
316
+ "ID": "TR_a83451e4",
317
+ "parent": "ElectrochemicalTesting",
318
+ "child": "Impedimetry"
319
+ },
320
+ {
321
+ "ID": "TR_88fb0ea8",
322
+ "parent": "ElectrochemicalTesting",
323
+ "child": "Potentiometry"
324
+ },
325
+ {
326
+ "ID": "TR_212079cf",
327
+ "parent": "ElectrochemicalTesting",
328
+ "child": "Voltammetry"
329
+ },
330
+ {
331
+ "ID": "TR_5469e4ae",
332
+ "parent": "Microscopy",
333
+ "child": "AnalyticalElectronMicroscopy"
334
+ },
335
+ {
336
+ "ID": "TR_5f7c0dbd",
337
+ "parent": "Microscopy",
338
+ "child": "AtomicForceMicroscopy"
339
+ },
340
+ {
341
+ "ID": "TR_23e266dc",
342
+ "parent": "Microscopy",
343
+ "child": "ConfocalMicroscopy"
344
+ },
345
+ {
346
+ "ID": "TR_b14b4a49",
347
+ "parent": "Microscopy",
348
+ "child": "ElectronProbeMicroanalysis"
349
+ },
350
+ {
351
+ "ID": "TR_aa18030c",
352
+ "parent": "Microscopy",
353
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+ {
996
+ "ID": "TR_d3c255fd",
997
+ "parent": "ScatteringAndDiffraction",
998
+ "child": "XrayDiffraction"
999
+ },
1000
+ {
1001
+ "ID": "TR_03b2bc41",
1002
+ "parent": "ScatteringAndDiffraction",
1003
+ "child": "XrdGrazingIncidence"
1004
+ },
1005
+ {
1006
+ "ID": "TR_436c071f",
1007
+ "parent": "Osmometry",
1008
+ "child": "FreezingPointDepressionOsmometry"
1009
+ },
1010
+ {
1011
+ "ID": "TR_24cff1cc",
1012
+ "parent": "Osmometry",
1013
+ "child": "MembraneOsmometry"
1014
+ },
1015
+ {
1016
+ "ID": "TR_6ca599ea",
1017
+ "parent": "Osmometry",
1018
+ "child": "VaporPressureDepressionOsmometry"
1019
+ },
1020
+ {
1021
+ "ID": "TR_b689e7c4",
1022
+ "parent": "Porosimetry",
1023
+ "child": "GasAdsorptionPorosimetry"
1024
+ },
1025
+ {
1026
+ "ID": "TR_c1ae4bdd",
1027
+ "parent": "Porosimetry",
1028
+ "child": "MercuryPorosimetry"
1029
+ },
1030
+ {
1031
+ "ID": "TR_b41fc846",
1032
+ "parent": "SamplePreparation",
1033
+ "child": "Grinding"
1034
+ },
1035
+ {
1036
+ "ID": "TR_6df2bec7",
1037
+ "parent": "SamplePreparation",
1038
+ "child": "Milling"
1039
+ },
1040
+ {
1041
+ "ID": "TR_b57170a1",
1042
+ "parent": "SamplePreparation",
1043
+ "child": "Mounting"
1044
+ },
1045
+ {
1046
+ "ID": "TR_7bb9bb64",
1047
+ "parent": "SamplePreparation",
1048
+ "child": "Polishing"
1049
+ },
1050
+ {
1051
+ "ID": "TR_a4b9728d",
1052
+ "parent": "SamplePreparation",
1053
+ "child": "SamplePreparationByCutting"
1054
+ },
1055
+ {
1056
+ "ID": "TR_b9b3c908",
1057
+ "parent": "CharacterisationProcedure",
1058
+ "child": "MeasurementSystemAdjustment"
1059
+ },
1060
+ {
1061
+ "ID": "TR_21caff8c",
1062
+ "parent": "SamplePreparation",
1063
+ "child": "Mounting"
1064
+ },
1065
+ {
1066
+ "ID": "TR_5b9b7c3e",
1067
+ "parent": "DataFiltering",
1068
+ "child": "OutlierRemoval"
1069
+ },
1070
+ {
1071
+ "ID": "TR_f033860c",
1072
+ "parent": "CharacterisationProcedure",
1073
+ "child": "SampleExtraction"
1074
+ },
1075
+ {
1076
+ "ID": "TR_20849f74",
1077
+ "parent": "CharacterisationProcedure",
1078
+ "child": "SampleExtraction"
1079
+ },
1080
+ {
1081
+ "ID": "TR_9699b856",
1082
+ "parent": "SampleExtraction",
1083
+ "child": "SampleExtractionByCutting"
1084
+ },
1085
+ {
1086
+ "ID": "TR_bbe916d8",
1087
+ "parent": "SamplePreparation",
1088
+ "child": "SamplePreparationByCutting"
1089
+ },
1090
+ {
1091
+ "ID": "TR_7598adfd",
1092
+ "parent": "SampleExtraction",
1093
+ "child": "SampleExtractionByCutting"
1094
+ },
1095
+ {
1096
+ "ID": "TR_fc002f03",
1097
+ "parent": "CharacterisationProcedure",
1098
+ "child": "SampleInspection"
1099
+ },
1100
+ {
1101
+ "ID": "TR_48433169",
1102
+ "parent": "CharacterisationProcedure",
1103
+ "child": "SampleInspection"
1104
+ },
1105
+ {
1106
+ "ID": "TR_b245e9c5",
1107
+ "parent": "CharacterisationProcedure",
1108
+ "child": "SampleInspection"
1109
+ },
1110
+ {
1111
+ "ID": "TR_f194dc05",
1112
+ "parent": "CharacterisationProcedure",
1113
+ "child": "SampleInspection"
1114
+ },
1115
+ {
1116
+ "ID": "TR_5191e446",
1117
+ "parent": "CharacterisationProcedure",
1118
+ "child": "SamplePreparation"
1119
+ },
1120
+ {
1121
+ "ID": "TR_bae3b6be",
1122
+ "parent": "CharacterisationProcedure",
1123
+ "child": "SamplePreparation"
1124
+ },
1125
+ {
1126
+ "ID": "TR_66330d33",
1127
+ "parent": "CharacterisationProcedure",
1128
+ "child": "SamplePreparation"
1129
+ },
1130
+ {
1131
+ "ID": "TR_98b4365a",
1132
+ "parent": "CharacterisationProcedure",
1133
+ "child": "SamplePreparation"
1134
+ },
1135
+ {
1136
+ "ID": "TR_5af82b0b",
1137
+ "parent": "DCPolarography",
1138
+ "child": "SampledDCPolarography"
1139
+ },
1140
+ {
1141
+ "ID": "TR_4ce40260",
1142
+ "parent": "HydrodynamicVoltammetry",
1143
+ "child": "VoltammetryAtARotatingDiskElectrode"
1144
+ },
1145
+ {
1146
+ "ID": "TR_d7fb10f2",
1147
+ "parent": "XrayDiffraction",
1148
+ "child": "XrayPowderDiffraction"
1149
+ }
1150
+ ]
1151
+ }
bmo/bmo.rst ADDED
@@ -0,0 +1,69 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Building Material Ontology (BMO)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ Building Material Ontology defines the main concepts of building material,
7
+ types, layers, and properties.
8
+
9
+ :Domain: Materials Science and Engineering
10
+ :Category: Materials
11
+ :Current Version: 0.1
12
+ :Last Updated: 2019-12-10
13
+ :Creator: Janakiram Karlapudi, Prathap Valluru
14
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
15
+ :Format: TTL
16
+ :Download: `Building Material Ontology (BMO) Homepage <https://matportal.org/ontologies/BUILDMAT>`_
17
+
18
+ Graph Metrics
19
+ -------------
20
+ - **Total Nodes**: 203
21
+ - **Total Edges**: 420
22
+ - **Root Nodes**: 83
23
+ - **Leaf Nodes**: 68
24
+
25
+ Knowledge coverage
26
+ ------------------
27
+ - Classes: 24
28
+ - Individuals: 12
29
+ - Properties: 62
30
+
31
+ Hierarchical metrics
32
+ --------------------
33
+ - **Maximum Depth**: 6
34
+ - **Minimum Depth**: 0
35
+ - **Average Depth**: 0.91
36
+ - **Depth Variance**: 1.30
37
+
38
+ Breadth metrics
39
+ ------------------
40
+ - **Maximum Breadth**: 83
41
+ - **Minimum Breadth**: 1
42
+ - **Average Breadth**: 27.29
43
+ - **Breadth Variance**: 1092.20
44
+
45
+ Dataset Statistics
46
+ ------------------
47
+ Generated Benchmarks:
48
+ - **Term Types**: 12
49
+ - **Taxonomic Relations**: 20
50
+ - **Non-taxonomic Relations**: 0
51
+ - **Average Terms per Type**: 3.00
52
+
53
+ Usage Example
54
+ -------------
55
+ .. code-block:: python
56
+
57
+ from ontolearner.ontology import BMO
58
+
59
+ # Initialize and load ontology
60
+ ontology = BMO()
61
+ ontology.load("path/to/ontology.TTL")
62
+
63
+ # Extract datasets
64
+ data = ontology.extract()
65
+
66
+ # Access specific relations
67
+ term_types = data.term_typings
68
+ taxonomic_relations = data.type_taxonomies
69
+ non_taxonomic_relations = data.type_non_taxonomic_relations
bmo/bmo.ttl ADDED
@@ -0,0 +1,781 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ @prefix : <https://w3id.org/digitalconstruction/BuildingMaterials#> .
2
+ @prefix owl: <http://www.w3.org/2002/07/owl#> .
3
+ @prefix rdf: <http://www.w3.org/1999/02/22-rdf-syntax-ns#> .
4
+ @prefix xml: <http://www.w3.org/XML/1998/namespace> .
5
+ @prefix xsd: <http://www.w3.org/2001/XMLSchema#> .
6
+ @prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#> .
7
+ @base <https://w3id.org/digitalconstruction/BuildingMaterials> .
8
+
9
+ <https://w3id.org/digitalconstruction/BuildingMaterials> rdf:type owl:Ontology ;
10
+ owl:imports <https://w3id.org/digitalconstruction/Entities#> ;
11
+ <http://purl.org/dc/terms/license> <https://creativecommons.org/licenses/by/4.0/> ;
12
+ <http://purl.org/dc/terms/creator> "Janakiram Karlapudi ([email protected])" ;
13
+ <http://purl.org/dc/terms/creator> "Prathap Valluru ([email protected])" ;
14
+ <http://purl.org/dc/terms/abstract> "Building Material Ontology defines the main concepts of building material, types, layers, and properties" ;
15
+ <http://purl.org/dc/terms/description> "The Building Material Ontology defines the main concepts of building material, types, layers, and properties"^^rdfs:Literal ;
16
+ <http://purl.org/dc/terms/created> "2019-12-10T16:00:00"^^xsd:dateTime ;
17
+ <http://purl.org/dc/terms/issued> "2019-12-10T16:00:00"^^xsd:dateTime ;
18
+ <http://purl.org/dc/terms/title> "Digital Construction - BuildingMaterials"^^rdfs:Literal ;
19
+ <http://purl.org/vocab/vann/preferredNamespacePrefix> "BMO"^^rdfs:Literal ;
20
+ <http://purl.org/vocab/vann/preferredNamespaceUri> "<https://w3id.org/digitalconstruction/BuildingMaterials#>"^^rdfs:Literal ;
21
+ owl:versionInfo "0.1"^^rdfs:Literal ;
22
+ rdfs:label "Digital construction - BuildingMaterials" ;
23
+ rdfs:seeAlso <https://w3id.org/digitalconstruction> .
24
+
25
+ #################################################################
26
+ # Annotation properties
27
+ #################################################################
28
+
29
+ ### http://purl.org/dc/elements/1.1/license
30
+ <http://purl.org/dc/elements/1.1/license> rdf:type owl:AnnotationProperty .
31
+
32
+
33
+ ### http://purl.org/dc/terms/contributor
34
+ <http://purl.org/dc/terms/contributor> rdf:type owl:AnnotationProperty .
35
+
36
+
37
+ ### http://purl.org/dc/terms/creator
38
+ <http://purl.org/dc/terms/creator> rdf:type owl:AnnotationProperty .
39
+
40
+
41
+ ### http://purl.org/dc/terms/description
42
+ <http://purl.org/dc/terms/description> rdf:type owl:AnnotationProperty .
43
+
44
+ ### http://purl.org/dc/terms/issued
45
+ <http://purl.org/dc/terms/issued> rdf:type owl:AnnotationProperty .
46
+
47
+
48
+ ### http://purl.org/dc/terms/license
49
+ <http://purl.org/dc/terms/license> rdf:type owl:AnnotationProperty .
50
+
51
+
52
+ ### http://purl.org/dc/terms/modified
53
+ <http://purl.org/dc/terms/modified> rdf:type owl:AnnotationProperty .
54
+
55
+
56
+ ### http://purl.org/dc/terms/title
57
+ <http://purl.org/dc/terms/title> rdf:type owl:AnnotationProperty .
58
+
59
+
60
+ ### http://purl.org/vocab/vann/preferredNamespacePrefix
61
+ <http://purl.org/vocab/vann/preferredNamespacePrefix> rdf:type owl:AnnotationProperty .
62
+
63
+
64
+ ### http://purl.org/vocab/vann/preferredNamespaceUri
65
+ <http://purl.org/vocab/vann/preferredNamespaceUri> rdf:type owl:AnnotationProperty .
66
+
67
+
68
+ #################################################################
69
+ # Object Properties
70
+ #################################################################
71
+
72
+
73
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasAcidityConcentration
74
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasAcidityConcentration> rdf:type owl:ObjectProperty ;
75
+ rdfs:subPropertyOf :hasProperty ;
76
+ rdfs:range :MaterialChemicalProperty ;
77
+ rdfs:comment "Maximum CaCO3 equivalent that would neutralize the acid."^^xsd:string .
78
+
79
+
80
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasAlkalinityConcentration
81
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasAlkalinityConcentration> rdf:type owl:ObjectProperty ;
82
+ rdfs:subPropertyOf :hasProperty ;
83
+ rdfs:range :MaterialChemicalProperty ;
84
+ rdfs:comment "Maximum alkalinity concentration (maximum sum of concentrations of each of the negative ions substances measured as CaCO3)."^^xsd:string .
85
+
86
+
87
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasBoilingPoint
88
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasBoilingPoint> rdf:type owl:ObjectProperty ;
89
+ rdfs:subPropertyOf :hasProperty ;
90
+ rdfs:domain :Material ;
91
+ rdfs:range :MaterialThermalProperty .
92
+
93
+
94
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasCO2Content
95
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasCO2Content> rdf:type owl:ObjectProperty ;
96
+ rdfs:subPropertyOf :hasProperty ;
97
+ rdfs:domain :Material ;
98
+ rdfs:range :MaterialCombustionProperty .
99
+
100
+
101
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasCOContent
102
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasCOContent> rdf:type owl:ObjectProperty ;
103
+ rdfs:subPropertyOf :hasProperty ;
104
+ rdfs:domain :Material ;
105
+ rdfs:range :MaterialCombustionProperty .
106
+
107
+
108
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasCarbonContent
109
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasCarbonContent> rdf:type owl:ObjectProperty ;
110
+ rdfs:subPropertyOf :hasProperty ;
111
+ rdfs:domain :Material ;
112
+ rdfs:range :MaterialFuelProperty ;
113
+ rdfs:comment "The carbon content in the fuel. This is measured in weight of carbon per unit weight of fuel and is therefore unitless. [ISO 16739-1:2018]"^^xsd:string .
114
+
115
+
116
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasCombustionTemperature
117
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasCombustionTemperature> rdf:type owl:ObjectProperty ;
118
+ rdfs:subPropertyOf :hasProperty ;
119
+ rdfs:domain :Material ;
120
+ rdfs:range :MaterialFuelProperty ;
121
+ rdfs:comment "Combustion temperature of the material when air is at 298 K and 100 kPa. [ISO 16739-1:2018]"^^xsd:string .
122
+
123
+
124
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasConstituents
125
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasConstituents> rdf:type owl:ObjectProperty ;
126
+ rdfs:subPropertyOf :hasProperty ;
127
+ rdfs:range :Material .
128
+
129
+
130
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasDynamicViscosity
131
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasDynamicViscosity> rdf:type owl:ObjectProperty ;
132
+ rdfs:subPropertyOf :hasProperty ;
133
+ rdfs:domain :Material ;
134
+ rdfs:range :MaterialMechanicalProperty ;
135
+ rdfs:comment "A measure of the viscous resistance of the material. [ISO 16739-1:2018]"^^xsd:string .
136
+
137
+
138
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasFreezingPoint
139
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasFreezingPoint> rdf:type owl:ObjectProperty ;
140
+ rdfs:subPropertyOf :hasProperty ;
141
+ rdfs:domain :Material ;
142
+ rdfs:range :MaterialThermalProperty .
143
+
144
+
145
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasGasPressure
146
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasGasPressure> rdf:type owl:ObjectProperty ;
147
+ rdfs:subPropertyOf :hasProperty ;
148
+ rdfs:domain :Material ;
149
+ rdfs:range :MaterialEnergyProperty ;
150
+ rdfs:comment "Fill pressure (e.g. for between-pane gas fills): the pressure exerted by a mass of gas confined in a constant volume. [ISO 16739-1:2018]"^^xsd:string .
151
+
152
+
153
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasHardness
154
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasHardness> rdf:type owl:ObjectProperty ;
155
+ rdfs:subPropertyOf :hasProperty ;
156
+ rdfs:domain :Material ;
157
+ rdfs:range :MaterialChemicalProperty ;
158
+ rdfs:comment "Water hardness as positive, multivalent ion concentration in the water (usually concentrations of calcium and magnesium ions in terms of calcium carbonate)."^^xsd:string .
159
+
160
+
161
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasHigherHeatingValue
162
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasHigherHeatingValue> rdf:type owl:ObjectProperty ;
163
+ rdfs:subPropertyOf :hasProperty ;
164
+ rdfs:domain :Material ;
165
+ rdfs:range :MaterialFuelProperty ;
166
+ rdfs:comment "Higher Heating Value is defined as the amount of energy released (MJ/kg) when a fuel is burned completely, and H2O is in liquid form in the combustion products. [ISO 16739-1:2018]"^^xsd:string .
167
+
168
+
169
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasIsothermalMoistureCapacity
170
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasIsothermalMoistureCapacity> rdf:type owl:ObjectProperty ;
171
+ rdfs:subPropertyOf :hasProperty ;
172
+ rdfs:domain :Material ;
173
+ rdfs:range :MaterialHygroscopicProperty ;
174
+ rdfs:comment "Based on water vapor density. [ISO 16739-1:2018]"^^xsd:string .
175
+
176
+
177
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasLowerHeatingValue
178
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasLowerHeatingValue> rdf:type owl:ObjectProperty ;
179
+ rdfs:subPropertyOf :hasProperty ;
180
+ rdfs:domain :Material ;
181
+ rdfs:range :MaterialFuelProperty ;
182
+ rdfs:comment "Lower Heating Value is defined as the amount of energy released (MJ/kg) when a fuel is burned completely, and H2O is in vapor form in the combustion products. [ISO 16739-1:2018]"^^xsd:string .
183
+
184
+
185
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasLowerVaporResistanceFactor
186
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasLowerVaporResistanceFactor> rdf:type owl:ObjectProperty ;
187
+ rdfs:subPropertyOf :hasProperty ;
188
+ rdfs:domain :Material ;
189
+ rdfs:range :MaterialHygroscopicProperty ;
190
+ rdfs:comment "The vapor permeability relationship of air/material (typically value > 1), measured in low relative humidity (typically in 0/50 % RH). [ISO 16739-1:2018]"^^xsd:string .
191
+
192
+
193
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasMassDensity
194
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasMassDensity> rdf:type owl:ObjectProperty ;
195
+ rdfs:subPropertyOf :hasProperty ;
196
+ rdfs:domain :Material ;
197
+ rdfs:range :MaterialPhysicalProperty ;
198
+ rdfs:comment "Material mass density. [ISO 16739-1:2018]"^^xsd:string .
199
+
200
+
201
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasMaterialName
202
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasMaterialName> rdf:type owl:ObjectProperty ;
203
+ rdfs:domain :Material ;
204
+ rdfs:range :MaterialType ;
205
+ rdfs:comment "It will assign the material name(material type) to the material"^^xsd:string .
206
+
207
+
208
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasMoistureCapacityThermalGradient
209
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasMoistureCapacityThermalGradient> rdf:type owl:ObjectProperty ;
210
+ rdfs:subPropertyOf :hasProperty ;
211
+ rdfs:domain :Material ;
212
+ rdfs:range :MaterialEnergyProperty ;
213
+ rdfs:comment "Thermal gradient coefficient for moisture capacity. Based on water vapor density.[ISO 16739-1:2018]"^^xsd:string .
214
+
215
+
216
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasMoistureDiffusivity
217
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasMoistureDiffusivity> rdf:type owl:ObjectProperty ;
218
+ rdfs:subPropertyOf :hasProperty ;
219
+ rdfs:domain :Material ;
220
+ rdfs:range :MaterialHygroscopicProperty ;
221
+ rdfs:comment """Moisture diffusivity is a transport property that is frequently used in the hygrothermal analysis of building envelope components.
222
+ Moisture diffusivity is a transport property that is frequently used in the hygrothermal analysis of building envelope components. [ISO 16739-1:2018]"""^^xsd:string .
223
+
224
+
225
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasMolecularWeight
226
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasMolecularWeight> rdf:type owl:ObjectProperty ;
227
+ rdfs:subPropertyOf :hasProperty ;
228
+ rdfs:domain :Material ;
229
+ rdfs:range :MaterialPhysicalProperty .
230
+
231
+
232
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasN20Content
233
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasN20Content> rdf:type owl:ObjectProperty ;
234
+ rdfs:subPropertyOf :hasProperty ;
235
+ rdfs:domain :Material ;
236
+ rdfs:range :MaterialCombustionProperty .
237
+
238
+
239
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasPHLevel
240
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasPHLevel> rdf:type owl:ObjectProperty ;
241
+ rdfs:subPropertyOf :hasProperty ;
242
+ rdfs:domain :Material ;
243
+ rdfs:range :MaterialChemicalProperty ;
244
+ rdfs:comment "Maximum water PH in a range from 0-14."^^xsd:string .
245
+
246
+
247
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasPoissonRatio
248
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasPoissonRatio> rdf:type owl:ObjectProperty ;
249
+ rdfs:subPropertyOf :hasProperty ;
250
+ rdfs:domain :Material ;
251
+ rdfs:range :MaterialMechanicalProperty ;
252
+ rdfs:comment "A measure of the lateral deformations in the elastic range. [ISO 16739-1:2018]"^^xsd:string .
253
+
254
+
255
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasPorosity
256
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasPorosity> rdf:type owl:ObjectProperty ;
257
+ rdfs:subPropertyOf :hasProperty ;
258
+ rdfs:domain :Material ;
259
+ rdfs:range :MaterialPhysicalProperty .
260
+
261
+
262
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasShearModulus
263
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasShearModulus> rdf:type owl:ObjectProperty ;
264
+ rdfs:subPropertyOf :hasProperty ;
265
+ rdfs:domain :Material ;
266
+ rdfs:range :MaterialMechanicalProperty ;
267
+ rdfs:comment "A measure of the shear modulus of elasticity of the material. [ISO 16739-1:2018]"^^xsd:string .
268
+
269
+
270
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarReflectanceBack
271
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarReflectanceBack> rdf:type owl:ObjectProperty ;
272
+ rdfs:subPropertyOf :hasProperty ;
273
+ rdfs:domain :Material ;
274
+ rdfs:range :MaterialOpticalProperty ;
275
+ rdfs:comment "Reflectance at normal incidence (solar): back side. Defines the fraction of the solar ray that is reflected and not transmitted when the ray passes from one medium into another, at the \"back\" side of the other material, perpendicular to the surface. Dependent on material and surface characteristics. [ISO 16739-1:2018]"^^xsd:string .
276
+
277
+
278
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarReflectanceFront
279
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarReflectanceFront> rdf:type owl:ObjectProperty ;
280
+ rdfs:subPropertyOf :hasProperty ;
281
+ rdfs:domain :Material ;
282
+ rdfs:range :MaterialOpticalProperty ;
283
+ rdfs:comment "Reflectance at normal incidence (solar): front side. Defines the fraction of the solar ray that is reflected and not transmitted when the ray passes from one medium into another, at the \"front\" side of the other material, perpendicular to the surface. Dependent on material and surface characteristics.[ISO 16739-1:2018]"^^xsd:string .
284
+
285
+
286
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarRefractionIndex
287
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarRefractionIndex> rdf:type owl:ObjectProperty ;
288
+ rdfs:subPropertyOf :hasProperty ;
289
+ rdfs:domain :Material ;
290
+ rdfs:range :MaterialEnergyProperty ;
291
+ rdfs:comment "Index of refraction (solar) defines the \"bending\" of the solar ray when it passes from one medium into another. [ISO 16739-1:2018]"^^xsd:string .
292
+
293
+
294
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarTransmittance
295
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasSolarTransmittance> rdf:type owl:ObjectProperty ;
296
+ rdfs:subPropertyOf :hasProperty ;
297
+ rdfs:domain :Material ;
298
+ rdfs:range :MaterialOpticalProperty ;
299
+ rdfs:comment "Transmittance at normal incidence (solar). Defines the fraction of solar radiation that passes through per unit area, perpendicular to the surface. [ISO 16739-1:2018]"^^xsd:string .
300
+
301
+
302
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasSpecificHeatCapacity
303
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasSpecificHeatCapacity> rdf:type owl:ObjectProperty ;
304
+ rdfs:subPropertyOf :hasProperty ;
305
+ rdfs:domain :Material ;
306
+ rdfs:range :MaterialThermalProperty .
307
+
308
+
309
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasSpecificHeatTemperatureDerivative
310
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasSpecificHeatTemperatureDerivative> rdf:type owl:ObjectProperty ;
311
+ rdfs:subPropertyOf :hasProperty ;
312
+ rdfs:domain :Material ;
313
+ rdfs:range :MaterialEnergyProperty ;
314
+ rdfs:comment "Specific heat temperature derivative. [ISO 16739-1:2018]"^^xsd:string .
315
+
316
+
317
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalCapacity
318
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalCapacity> rdf:type owl:ObjectProperty ;
319
+ rdfs:subPropertyOf :hasProperty ;
320
+ rdfs:range :MaterialThermalProperty .
321
+
322
+
323
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalConductivity
324
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalConductivity> rdf:type owl:ObjectProperty ;
325
+ rdfs:subPropertyOf :hasProperty ;
326
+ rdfs:domain :Material ;
327
+ rdfs:range :MaterialThermalProperty .
328
+
329
+
330
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalConductivityTemperatureDerivative
331
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalConductivityTemperatureDerivative> rdf:type owl:ObjectProperty ;
332
+ rdfs:subPropertyOf :hasProperty ;
333
+ rdfs:domain :Material ;
334
+ rdfs:range :MaterialEnergyProperty ;
335
+ rdfs:comment "Thermal conductivity temperature derivative. [ISO 16739-1:2018]"^^xsd:string .
336
+
337
+
338
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalExpansionCoefficient
339
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalExpansionCoefficient> rdf:type owl:ObjectProperty ;
340
+ rdfs:subPropertyOf :hasProperty ;
341
+ rdfs:domain :Material ;
342
+ rdfs:range :MaterialMechanicalProperty ;
343
+ rdfs:comment "A measure of the expansion coefficient for warming up the material about one Kelvin. [ISO 16739-1:2018]"^^xsd:string .
344
+
345
+
346
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalIrEmissivityBack
347
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalIrEmissivityBack> rdf:type owl:ObjectProperty ;
348
+ rdfs:subPropertyOf :hasProperty ;
349
+ rdfs:domain :Material ;
350
+ rdfs:range :MaterialOpticalProperty ;
351
+ rdfs:comment "Thermal IR emissivity: back side. Defines the fraction of thermal energy emitted per unit area to \"blackbody\" at the same temperature, through the \"back\" side of the material. [ISO 16739-1:2018]"^^xsd:string .
352
+
353
+
354
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalIrEmissivityFront
355
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalIrEmissivityFront> rdf:type owl:ObjectProperty ;
356
+ rdfs:subPropertyOf :hasProperty ;
357
+ rdfs:domain :Material ;
358
+ rdfs:range :MaterialOpticalProperty ;
359
+ rdfs:comment "Thermal IR emissivity: front side. Defines the fraction of thermal energy emitted per unit area to \"blackbody\" at the same temperature, through the \"front\" side of the material.[ISO 16739-1:2018]"^^xsd:string .
360
+
361
+
362
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalIrTransmittance
363
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalIrTransmittance> rdf:type owl:ObjectProperty ;
364
+ rdfs:subPropertyOf :hasProperty ;
365
+ rdfs:domain :Material ;
366
+ rdfs:range :MaterialOpticalProperty ;
367
+ rdfs:comment "Thermal IR transmittance at normal incidence. Defines the fraction of thermal energy that passes through per unit area, perpendicular to the surface. [ISO 16739-1:2018]"^^xsd:string .
368
+
369
+
370
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalResistivity
371
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasThermalResistivity> rdf:type owl:ObjectProperty ;
372
+ rdfs:subPropertyOf :hasProperty ;
373
+ rdfs:range :MaterialThermalProperty .
374
+
375
+
376
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasUnit
377
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasUnit> rdf:type owl:ObjectProperty ;
378
+ rdfs:domain :Property ;
379
+ rdfs:range <http://qudt.org/schema/qudt/Unit> ;
380
+ owl:propertyDisjointWith :hasProperty ;
381
+ rdfs:comment "It is used to assign the unit to the property"^^xsd:string .
382
+
383
+
384
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasUpperVaporResistanceFactor
385
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasUpperVaporResistanceFactor> rdf:type owl:ObjectProperty ;
386
+ rdfs:subPropertyOf :hasProperty ;
387
+ rdfs:domain :Material ;
388
+ rdfs:range :MaterialHygroscopicProperty ;
389
+ rdfs:comment "The vapor permeability relationship of air/material (typically value > 1), measured in high relative humidity (typically in 95/50 % RH). [ISO 16739-1:2018]"^^xsd:string .
390
+
391
+
392
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasVaporPermeability
393
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasVaporPermeability> rdf:type owl:ObjectProperty ;
394
+ rdfs:subPropertyOf :hasProperty ;
395
+ rdfs:domain :Material ;
396
+ rdfs:range :MaterialHygroscopicProperty ;
397
+ rdfs:comment "The rate of water vapor transmission per unit area per unit of vapor pressure differential under test conditions. [ISO 16739-1:2018]"^^xsd:string .
398
+
399
+
400
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasViscosityTemperatureDerivative
401
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasViscosityTemperatureDerivative> rdf:type owl:ObjectProperty ;
402
+ rdfs:subPropertyOf :hasProperty ;
403
+ rdfs:domain :Material ;
404
+ rdfs:range :MaterialEnergyProperty ;
405
+ rdfs:comment "Viscosity temperature derivative. [ISO 16739-1:2018]"^^xsd:string .
406
+
407
+
408
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleReflectanceBack
409
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleReflectanceBack> rdf:type owl:ObjectProperty ;
410
+ rdfs:subPropertyOf :hasProperty ;
411
+ rdfs:domain :Material ;
412
+ rdfs:range :MaterialOpticalProperty ;
413
+ rdfs:comment "Reflectance at normal incidence (visible): back side. Defines the fraction of the solar ray in the visible spectrum that is reflected and not transmitted when the ray passes from one medium into another, at the \"back\" side of the other material, perpendicular to the surface. Dependent on material and surface characteristics.[ISO 16739-1:2018]"^^xsd:string .
414
+
415
+
416
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleReflectanceFront
417
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleReflectanceFront> rdf:type owl:ObjectProperty ;
418
+ rdfs:subPropertyOf :hasProperty ;
419
+ rdfs:domain :Material ;
420
+ rdfs:range :MaterialOpticalProperty ;
421
+ rdfs:comment "Reflectance at normal incidence (visible): front side. Defines the fraction of the solar ray in the visible spectrum that is reflected and not transmitted when the ray passes from one medium into another, at the \"front\" side of the other material, perpendicular to the surface. Dependent on material and surface characteristics.[ISO 16739-1:2018]"^^xsd:string .
422
+
423
+
424
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleRefractionIndex
425
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleRefractionIndex> rdf:type owl:ObjectProperty ;
426
+ rdfs:subPropertyOf :hasProperty ;
427
+ rdfs:domain :Material ;
428
+ rdfs:range :MaterialEnergyProperty ;
429
+ rdfs:comment "Index of refraction (visible) defines the \"bending\" of the sola! r ray in the visible spectrum when it passes from one medium into another. [ISO 16739-1:2018]"^^xsd:string .
430
+
431
+
432
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleTransmittance
433
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasVisibleTransmittance> rdf:type owl:ObjectProperty ;
434
+ rdfs:subPropertyOf :hasProperty ;
435
+ rdfs:domain :Material ;
436
+ rdfs:range :MaterialOpticalProperty ;
437
+ rdfs:comment "Transmittance at normal incidence (visible). Defines the fraction of the visible spectrum of solar radiation that passes through per unit area, perpendicular to the surface. [ISO 16739-1:2018]"^^xsd:string .
438
+
439
+
440
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasYoungModulus
441
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasYoungModulus> rdf:type owl:ObjectProperty ;
442
+ rdfs:subPropertyOf :hasProperty ;
443
+ rdfs:domain :Material ;
444
+ rdfs:range :MaterialMechanicalProperty ;
445
+ rdfs:comment "A measure of the Young's modulus of elasticity of the material. [ISO 16739-1:2018]"^^xsd:string .
446
+
447
+
448
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#IsInnerLayerOf
449
+ :IsInnerLayerOf rdf:type owl:ObjectProperty ;
450
+ rdfs:domain :Layer ;
451
+ rdfs:range <https://w3id.org/digitalconstruction/Entities#BuildingObject> .
452
+
453
+
454
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#IsOuterLayerOf
455
+ :IsOuterLayerOf rdf:type owl:ObjectProperty ;
456
+ rdfs:domain :Layer ;
457
+ rdfs:range <https://w3id.org/digitalconstruction/Entities#BuildingObject> .
458
+
459
+
460
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#adjacentLayer
461
+ :adjacentLayer rdf:type owl:ObjectProperty ,
462
+ owl:SymmetricProperty ;
463
+ rdfs:domain :Layer ;
464
+ rdfs:range :Layer .
465
+
466
+
467
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasConstituents
468
+ :hasConstituents rdf:type owl:ObjectProperty ;
469
+ rdfs:domain :ConstituentSet ;
470
+ rdfs:range :Constituent .
471
+
472
+
473
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasLayers
474
+ :hasLayers rdf:type owl:ObjectProperty ;
475
+ rdfs:domain :LayerSet ;
476
+ rdfs:range :Layer .
477
+
478
+
479
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasMaterial
480
+ :hasMaterial rdf:type owl:ObjectProperty ;
481
+ rdfs:domain :MaterialDefinition ;
482
+ rdfs:range :Material .
483
+
484
+
485
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasProfiles
486
+ :hasProfiles rdf:type owl:ObjectProperty ;
487
+ rdfs:domain :ProfileSet ;
488
+ rdfs:range :Profile .
489
+
490
+
491
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasProperty
492
+ :hasProperty rdf:type owl:ObjectProperty .
493
+
494
+
495
+ #################################################################
496
+ # Data properties
497
+ #################################################################
498
+
499
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasDefinedValue
500
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasDefinedValue> rdf:type owl:DatatypeProperty ;
501
+ rdfs:subPropertyOf :hasValue ;
502
+ rdfs:domain :Property ;
503
+ rdfs:range xsd:double ;
504
+ rdfs:comment "Defined value is the standard value taken from the authenticated sources. For example, it is a value taken from the standards."^^xsd:string .
505
+
506
+
507
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasEstimatedValue
508
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasEstimatedValue> rdf:type owl:DatatypeProperty ;
509
+ rdfs:subPropertyOf :hasValue ;
510
+ rdfs:domain :Property ;
511
+ rdfs:range xsd:double ;
512
+ rdfs:comment "Estimated value is the derived value or calculated value by using other property values"^^xsd:string .
513
+
514
+
515
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasMeasuredValue
516
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasMeasuredValue> rdf:type owl:DatatypeProperty ;
517
+ rdfs:subPropertyOf :hasValue ;
518
+ rdfs:domain :Property ;
519
+ rdfs:range xsd:double ;
520
+ rdfs:comment "Measured Value is the resulted value from the measurement process"^^xsd:string .
521
+
522
+
523
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasReference
524
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasReference> rdf:type owl:DatatypeProperty ;
525
+ rdfs:subPropertyOf owl:topDataProperty ;
526
+ rdfs:domain :Property ;
527
+ rdfs:range xsd:string ;
528
+ rdfs:comment "hasRefrence: is used to represent the relation between property and the source from where it is taken."^^xsd:string .
529
+
530
+
531
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasValue
532
+ <https://w3id.org/digitalconstruction/BuildingMaterials#hasValue> rdf:type owl:DatatypeProperty ;
533
+ rdfs:subPropertyOf owl:topDataProperty ;
534
+ rdfs:domain :Property ;
535
+ rdfs:range xsd:double .
536
+
537
+
538
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#hasThickness
539
+ :hasThickness rdf:type owl:DatatypeProperty ;
540
+ rdfs:domain :Layer .
541
+
542
+
543
+ #################################################################
544
+ # Classes
545
+ #################################################################
546
+
547
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#CompositeMaterial
548
+ <https://w3id.org/digitalconstruction/BuildingMaterials#CompositeMaterial> rdf:type owl:Class ;
549
+ rdfs:subClassOf :MaterialType .
550
+
551
+
552
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#InorganicNonMetallicMaterial
553
+ <https://w3id.org/digitalconstruction/BuildingMaterials#InorganicNonMetallicMaterial> rdf:type owl:Class ;
554
+ rdfs:subClassOf :MaterialType .
555
+
556
+
557
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Material
558
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Material> rdf:type owl:Class ;
559
+ rdfs:comment "a homogeneous or inhomogeneous substance that can be used to form elements (physical products or their components). [ISO 16739]"^^xsd:string .
560
+
561
+
562
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialChemicalProperty
563
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialChemicalProperty> rdf:type owl:Class ;
564
+ rdfs:subClassOf :MaterialProperty .
565
+
566
+
567
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialCombustionProperty
568
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialCombustionProperty> rdf:type owl:Class ;
569
+ rdfs:subClassOf :MaterialProperty .
570
+
571
+
572
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialEnergyProperty
573
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialEnergyProperty> rdf:type owl:Class ;
574
+ rdfs:subClassOf :MaterialProperty .
575
+
576
+
577
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialFuelProperty
578
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialFuelProperty> rdf:type owl:Class ;
579
+ rdfs:subClassOf :MaterialProperty .
580
+
581
+
582
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialHygroscopicProperty
583
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialHygroscopicProperty> rdf:type owl:Class ;
584
+ rdfs:subClassOf :MaterialProperty .
585
+
586
+
587
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialMechanicalProperty
588
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialMechanicalProperty> rdf:type owl:Class ;
589
+ rdfs:subClassOf :MaterialProperty .
590
+
591
+
592
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialOpticalProperty
593
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialOpticalProperty> rdf:type owl:Class ;
594
+ rdfs:subClassOf :MaterialProperty .
595
+
596
+
597
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialPhysicalProperty
598
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialPhysicalProperty> rdf:type owl:Class ;
599
+ rdfs:subClassOf :MaterialProperty .
600
+
601
+
602
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialProperty
603
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialProperty> rdf:type owl:Class ;
604
+ rdfs:subClassOf :Property ;
605
+ rdfs:comment "It is a characterstic of a material"^^xsd:string .
606
+
607
+
608
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialThermalProperty
609
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialThermalProperty> rdf:type owl:Class ;
610
+ rdfs:subClassOf :MaterialProperty .
611
+
612
+
613
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialType
614
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MaterialType> rdf:type owl:Class ;
615
+ rdfs:comment "It represents the different types of a material."^^xsd:string .
616
+
617
+
618
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MetallicMaterial
619
+ <https://w3id.org/digitalconstruction/BuildingMaterials#MetallicMaterial> rdf:type owl:Class ;
620
+ rdfs:subClassOf :MaterialType .
621
+
622
+
623
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#OrganicaMaterial
624
+ <https://w3id.org/digitalconstruction/BuildingMaterials#OrganicaMaterial> rdf:type owl:Class ;
625
+ rdfs:subClassOf :MaterialType .
626
+
627
+
628
+
629
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Constituent
630
+ :Constituent rdf:type owl:Class ;
631
+ rdfs:subClassOf :MaterialDefinition .
632
+
633
+
634
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#ConstituentSet
635
+ :ConstituentSet rdf:type owl:Class ;
636
+ rdfs:subClassOf :MaterialDefinition .
637
+
638
+
639
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Layer
640
+ :Layer rdf:type owl:Class ;
641
+ rdfs:subClassOf :MaterialDefinition .
642
+
643
+
644
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#LayerSet
645
+ :LayerSet rdf:type owl:Class ;
646
+ rdfs:subClassOf :MaterialDefinition .
647
+
648
+
649
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#MaterialDefinition
650
+ :MaterialDefinition rdf:type owl:Class .
651
+
652
+
653
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Profile
654
+ :Profile rdf:type owl:Class ;
655
+ rdfs:subClassOf :MaterialDefinition .
656
+
657
+
658
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#ProfileSet
659
+ :ProfileSet rdf:type owl:Class ;
660
+ rdfs:subClassOf :MaterialDefinition .
661
+
662
+
663
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Property
664
+ :Property rdf:type owl:Class .
665
+
666
+
667
+ #################################################################
668
+ # Individuals
669
+ #################################################################
670
+
671
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Aluminium
672
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Aluminium> rdf:type owl:NamedIndividual ,
673
+ :MetallicMaterial .
674
+
675
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Bitumen
676
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Bitumen> rdf:type owl:NamedIndividual ,
677
+ :InorganicNonMetallicMaterial .
678
+
679
+
680
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#CastIron
681
+ <https://w3id.org/digitalconstruction/BuildingMaterials#CastIron> rdf:type owl:NamedIndividual ,
682
+ :MetallicMaterial .
683
+
684
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#CementStone
685
+ <https://w3id.org/digitalconstruction/BuildingMaterials#CementStone> rdf:type owl:NamedIndividual ,
686
+ :OrganicaMaterial .
687
+
688
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Ceramic
689
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Ceramic> rdf:type owl:NamedIndividual ,
690
+ :OrganicaMaterial .
691
+
692
+
693
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Concrete
694
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Concrete> rdf:type owl:NamedIndividual ,
695
+ :CompositeMaterial .
696
+
697
+
698
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Copper
699
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Copper> rdf:type owl:NamedIndividual ,
700
+ :MetallicMaterial .
701
+
702
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Glass
703
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Glass> rdf:type owl:NamedIndividual ,
704
+ :OrganicaMaterial .
705
+
706
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Masonry
707
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Masonry> rdf:type owl:NamedIndividual ,
708
+ :CompositeMaterial .
709
+
710
+
711
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Polymer
712
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Polymer> rdf:type owl:NamedIndividual ,
713
+ :InorganicNonMetallicMaterial .
714
+
715
+
716
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Steel
717
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Steel> rdf:type owl:NamedIndividual ,
718
+ :MetallicMaterial .
719
+
720
+
721
+ ### https://w3id.org/digitalconstruction/BuildingMaterials#Wood
722
+ <https://w3id.org/digitalconstruction/BuildingMaterials#Wood> rdf:type owl:NamedIndividual ,
723
+ :InorganicNonMetallicMaterial .
724
+
725
+
726
+ #################################################################
727
+ # General axioms
728
+ #################################################################
729
+
730
+ [ rdf:type owl:AllDisjointClasses ;
731
+ owl:members ( <http://qudt.org/schema/qudt/Unit>
732
+ :Material
733
+ :MaterialType
734
+ :Property
735
+ )
736
+ ] .
737
+
738
+
739
+ [ rdf:type owl:AllDisjointClasses ;
740
+ owl:members (:Material
741
+ :MaterialDefinition
742
+ )
743
+ ] .
744
+
745
+
746
+ [ rdf:type owl:AllDisjointClasses ;
747
+ owl:members ( :CompositeMaterial
748
+ :InorganicNonMetallicMaterial
749
+ :MetallicMaterial
750
+ :OrganicaMaterial
751
+ )
752
+ ] .
753
+
754
+
755
+ [ rdf:type owl:AllDisjointClasses ;
756
+ owl:members ( :Constituent
757
+ :ConstituentSet
758
+ :Layer
759
+ :LayerSet
760
+ :Profile
761
+ :ProfileSet
762
+ )
763
+ ] .
764
+
765
+
766
+ [ rdf:type owl:AllDisjointProperties ;
767
+ owl:members ( :hasReference
768
+ :hasValue
769
+ )
770
+ ] .
771
+
772
+
773
+ [ rdf:type owl:AllDisjointProperties ;
774
+ owl:members ( :hasDefinedValue
775
+ :hasEstimatedValue
776
+ :hasMeasuredValue
777
+ )
778
+ ] .
779
+
780
+
781
+ ### Generated by the OWL API (version 4.5.9.2019-02-01T07:24:44Z) https://github.com/owlcs/owlapi
bmo/term_typings.json ADDED
@@ -0,0 +1,86 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ [
2
+ {
3
+ "ID": "TT_3fd4df50",
4
+ "term": "Masonry",
5
+ "types": [
6
+ "CompositeMaterial"
7
+ ]
8
+ },
9
+ {
10
+ "ID": "TT_f4ddd84a",
11
+ "term": "Concrete",
12
+ "types": [
13
+ "CompositeMaterial"
14
+ ]
15
+ },
16
+ {
17
+ "ID": "TT_bb981e57",
18
+ "term": "Wood",
19
+ "types": [
20
+ "InorganicNonMetallicMaterial"
21
+ ]
22
+ },
23
+ {
24
+ "ID": "TT_5a9621e2",
25
+ "term": "Polymer",
26
+ "types": [
27
+ "InorganicNonMetallicMaterial"
28
+ ]
29
+ },
30
+ {
31
+ "ID": "TT_5c2008e4",
32
+ "term": "Bitumen",
33
+ "types": [
34
+ "InorganicNonMetallicMaterial"
35
+ ]
36
+ },
37
+ {
38
+ "ID": "TT_bb3af282",
39
+ "term": "CementStone",
40
+ "types": [
41
+ "OrganicaMaterial"
42
+ ]
43
+ },
44
+ {
45
+ "ID": "TT_5b59a756",
46
+ "term": "Glass",
47
+ "types": [
48
+ "OrganicaMaterial"
49
+ ]
50
+ },
51
+ {
52
+ "ID": "TT_43f093d4",
53
+ "term": "Ceramic",
54
+ "types": [
55
+ "OrganicaMaterial"
56
+ ]
57
+ },
58
+ {
59
+ "ID": "TT_5eccd74e",
60
+ "term": "Copper",
61
+ "types": [
62
+ "MetallicMaterial"
63
+ ]
64
+ },
65
+ {
66
+ "ID": "TT_1cb37adf",
67
+ "term": "CastIron",
68
+ "types": [
69
+ "MetallicMaterial"
70
+ ]
71
+ },
72
+ {
73
+ "ID": "TT_a8e840f7",
74
+ "term": "Aluminium",
75
+ "types": [
76
+ "MetallicMaterial"
77
+ ]
78
+ },
79
+ {
80
+ "ID": "TT_5ddad5f6",
81
+ "term": "Steel",
82
+ "types": [
83
+ "MetallicMaterial"
84
+ ]
85
+ }
86
+ ]
bmo/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,5 @@
 
 
 
 
 
 
1
+ {
2
+ "types": [],
3
+ "relations": [],
4
+ "non_taxonomies": []
5
+ }
bmo/type_taxonomies.json ADDED
@@ -0,0 +1,129 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "ConstituentSet",
4
+ "MaterialProperty",
5
+ "MaterialOpticalProperty",
6
+ "MaterialDefinition",
7
+ "Layer",
8
+ "MaterialType",
9
+ "ProfileSet",
10
+ "MaterialPhysicalProperty",
11
+ "LayerSet",
12
+ "MaterialCombustionProperty",
13
+ "MaterialEnergyProperty",
14
+ "Profile",
15
+ "MetallicMaterial",
16
+ "OrganicaMaterial",
17
+ "MaterialMechanicalProperty",
18
+ "Property",
19
+ "InorganicNonMetallicMaterial",
20
+ "MaterialFuelProperty",
21
+ "CompositeMaterial",
22
+ "Constituent",
23
+ "MaterialChemicalProperty",
24
+ "MaterialThermalProperty",
25
+ "MaterialHygroscopicProperty"
26
+ ],
27
+ "taxonomies": [
28
+ {
29
+ "ID": "TR_5d56039f",
30
+ "parent": "MaterialType",
31
+ "child": "CompositeMaterial"
32
+ },
33
+ {
34
+ "ID": "TR_2247ec81",
35
+ "parent": "MaterialType",
36
+ "child": "InorganicNonMetallicMaterial"
37
+ },
38
+ {
39
+ "ID": "TR_51ea3411",
40
+ "parent": "MaterialType",
41
+ "child": "MetallicMaterial"
42
+ },
43
+ {
44
+ "ID": "TR_f2f522a1",
45
+ "parent": "MaterialType",
46
+ "child": "OrganicaMaterial"
47
+ },
48
+ {
49
+ "ID": "TR_73dd9ed8",
50
+ "parent": "MaterialProperty",
51
+ "child": "MaterialChemicalProperty"
52
+ },
53
+ {
54
+ "ID": "TR_3e132db0",
55
+ "parent": "MaterialProperty",
56
+ "child": "MaterialCombustionProperty"
57
+ },
58
+ {
59
+ "ID": "TR_3ef530e6",
60
+ "parent": "MaterialProperty",
61
+ "child": "MaterialEnergyProperty"
62
+ },
63
+ {
64
+ "ID": "TR_b23b490a",
65
+ "parent": "MaterialProperty",
66
+ "child": "MaterialFuelProperty"
67
+ },
68
+ {
69
+ "ID": "TR_60405c44",
70
+ "parent": "MaterialProperty",
71
+ "child": "MaterialHygroscopicProperty"
72
+ },
73
+ {
74
+ "ID": "TR_c82b544e",
75
+ "parent": "MaterialProperty",
76
+ "child": "MaterialMechanicalProperty"
77
+ },
78
+ {
79
+ "ID": "TR_f96bf4de",
80
+ "parent": "MaterialProperty",
81
+ "child": "MaterialOpticalProperty"
82
+ },
83
+ {
84
+ "ID": "TR_ec1e70d1",
85
+ "parent": "MaterialProperty",
86
+ "child": "MaterialPhysicalProperty"
87
+ },
88
+ {
89
+ "ID": "TR_3bb45d3c",
90
+ "parent": "MaterialProperty",
91
+ "child": "MaterialThermalProperty"
92
+ },
93
+ {
94
+ "ID": "TR_ad5a9b2e",
95
+ "parent": "Property",
96
+ "child": "MaterialProperty"
97
+ },
98
+ {
99
+ "ID": "TR_0b9533b1",
100
+ "parent": "MaterialDefinition",
101
+ "child": "Constituent"
102
+ },
103
+ {
104
+ "ID": "TR_983b8897",
105
+ "parent": "MaterialDefinition",
106
+ "child": "ConstituentSet"
107
+ },
108
+ {
109
+ "ID": "TR_16e6bccd",
110
+ "parent": "MaterialDefinition",
111
+ "child": "Layer"
112
+ },
113
+ {
114
+ "ID": "TR_2ec89117",
115
+ "parent": "MaterialDefinition",
116
+ "child": "LayerSet"
117
+ },
118
+ {
119
+ "ID": "TR_badafc57",
120
+ "parent": "MaterialDefinition",
121
+ "child": "Profile"
122
+ },
123
+ {
124
+ "ID": "TR_1400bfb9",
125
+ "parent": "MaterialDefinition",
126
+ "child": "ProfileSet"
127
+ }
128
+ ]
129
+ }
bvco/bvco.rst ADDED
@@ -0,0 +1,71 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Battery Value Chain Ontology (BVCO)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ Basically, Battery Value Chain Ontology (BVCO) aims to model processes along the Battery value chain. Processes are
7
+ holistic perspective elements that transform inputs/educts (matter, energy, information)
8
+ into output/products (matter, energy, information) with the help of tools (devices, algorithms).
9
+ They can be decomposed into sub-processes and have predecessor and successor processes.
10
+
11
+ :Domain: Materials Science and Engineering
12
+ :Category: Materials Science
13
+ :Current Version: 0.4.3
14
+ :Last Updated: None
15
+ :Creator: Lukas Gold, Simon Stier
16
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
17
+ :Format: TTL
18
+ :Download: `Battery Value Chain Ontology (BVCO) Homepage <https://github.com/Battery-Value-Chain-Ontology/ontology>`_
19
+
20
+ Graph Metrics
21
+ -------------
22
+ - **Total Nodes**: 804
23
+ - **Total Edges**: 1719
24
+ - **Root Nodes**: 85
25
+ - **Leaf Nodes**: 283
26
+
27
+ Knowledge coverage
28
+ ------------------
29
+ - Classes: 262
30
+ - Individuals: 0
31
+ - Properties: 6
32
+
33
+ Hierarchical metrics
34
+ --------------------
35
+ - **Maximum Depth**: 14
36
+ - **Minimum Depth**: 0
37
+ - **Average Depth**: 2.47
38
+ - **Depth Variance**: 5.27
39
+
40
+ Breadth metrics
41
+ ------------------
42
+ - **Maximum Breadth**: 230
43
+ - **Minimum Breadth**: 2
44
+ - **Average Breadth**: 52.20
45
+ - **Breadth Variance**: 4920.43
46
+
47
+ Dataset Statistics
48
+ ------------------
49
+ Generated Benchmarks:
50
+ - **Term Types**: 0
51
+ - **Taxonomic Relations**: 0
52
+ - **Non-taxonomic Relations**: 0
53
+ - **Average Terms per Type**: 0.00
54
+
55
+ Usage Example
56
+ -------------
57
+ .. code-block:: python
58
+
59
+ from ontolearner.ontology import BVCO
60
+
61
+ # Initialize and load ontology
62
+ ontology = BVCO()
63
+ ontology.load("path/to/ontology.TTL")
64
+
65
+ # Extract datasets
66
+ data = ontology.extract()
67
+
68
+ # Access specific relations
69
+ term_types = data.term_typings
70
+ taxonomic_relations = data.type_taxonomies
71
+ non_taxonomic_relations = data.type_non_taxonomic_relations
bvco/bvco.ttl ADDED
The diff for this file is too large to render. See raw diff
 
bvco/term_typings.json ADDED
@@ -0,0 +1 @@
 
 
1
+ []
bvco/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,5 @@
 
 
 
 
 
 
1
+ {
2
+ "types": [],
3
+ "relations": [],
4
+ "non_taxonomies": []
5
+ }
bvco/type_taxonomies.json ADDED
@@ -0,0 +1,4 @@
 
 
 
 
 
1
+ {
2
+ "types": [],
3
+ "taxonomies": []
4
+ }
cdco/cdco.owl ADDED
@@ -0,0 +1,382 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ <?xml version="1.0"?>
2
+ <rdf:RDF xmlns="http://purls.helmholtz-metadaten.de/cdos/cdco#"
3
+ xml:base="http://purls.helmholtz-metadaten.de/cdos/cdco"
4
+ xmlns:dc="http://purl.org/dc/elements/1.1/"
5
+ xmlns:obo="http://purl.obolibrary.org/obo/"
6
+ xmlns:owl="http://www.w3.org/2002/07/owl#"
7
+ xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#"
8
+ xmlns:xml="http://www.w3.org/XML/1998/namespace"
9
+ xmlns:xsd="http://www.w3.org/2001/XMLSchema#"
10
+ xmlns:rdfs="http://www.w3.org/2000/01/rdf-schema#"
11
+ xmlns:skos="http://www.w3.org/2004/02/skos/core#"
12
+ xmlns:terms="http://purl.org/dc/terms/"
13
+ xmlns:schema="https://schema.org/">
14
+ <owl:Ontology rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco">
15
+ <owl:versionIRI rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/1.0.0"/>
16
+ <terms:creator rdf:resource="https://orcid.org/0000-0001-7564-7990"/>
17
+ <terms:description rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Crystallographic Defect Core Ontology (CDCO) defines the common terminology shared across all types of crystallographic defects, providing a unified framework for data integration in materials science.</terms:description>
18
+ <terms:title rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Crystallographic Defect Core Ontology (CDCO)</terms:title>
19
+ <rdfs:seeAlso rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://github.com/OCDO/cdco</rdfs:seeAlso>
20
+ <owl:versionInfo rdf:datatype="http://www.w3.org/2001/XMLSchema#string">1.0.0</owl:versionInfo>
21
+ <schema:citation rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Abril Azocar Guzman. (2025). Crystallographic Defect Core Ontology. http://purls.helmholtz-metadaten.de/cdos/cdco</schema:citation>
22
+ <schema:creativeWorkStatus rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Pre-release</schema:creativeWorkStatus>
23
+ <schema:funder rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://ror.org/05qj6w324</schema:funder>
24
+ <schema:logo rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://raw.githubusercontent.com/OCDO/.github/refs/heads/main/profile/ocdo_logo.png</schema:logo>
25
+ </owl:Ontology>
26
+
27
+
28
+
29
+ <!--
30
+ ///////////////////////////////////////////////////////////////////////////////////////
31
+ //
32
+ // Annotation properties
33
+ //
34
+ ///////////////////////////////////////////////////////////////////////////////////////
35
+ -->
36
+
37
+
38
+
39
+
40
+ <!-- http://purl.obolibrary.org/obo/IAO_0000111 -->
41
+
42
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000111"/>
43
+
44
+
45
+
46
+ <!-- http://purl.obolibrary.org/obo/IAO_0000114 -->
47
+
48
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000114"/>
49
+
50
+
51
+
52
+ <!-- http://purl.obolibrary.org/obo/IAO_0000115 -->
53
+
54
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000115">
55
+ <obo:IAO_0000111 xml:lang="en">definition</obo:IAO_0000111>
56
+ <obo:IAO_0000114 rdf:resource="http://purl.obolibrary.org/obo/IAO_0000122"/>
57
+ <obo:IAO_0000115 xml:lang="en">The official definition, explaining the meaning of a class or property. Shall be Aristotelian, formalized and normalized. Can be augmented with colloquial definitions.</obo:IAO_0000115>
58
+ <obo:IAO_0000116 xml:lang="en">2012-04-05:
59
+ Barry Smith
60
+
61
+ The official OBI definition, explaining the meaning of a class or property: &apos;Shall be Aristotelian, formalized and normalized. Can be augmented with colloquial definitions&apos; is terrible.
62
+
63
+ Can you fix to something like:
64
+
65
+ A statement of necessary and sufficient conditions explaining the meaning of an expression referring to a class or property.
66
+
67
+ Alan Ruttenberg
68
+
69
+ Your proposed definition is a reasonable candidate, except that it is very common that necessary and sufficient conditions are not given. Mostly they are necessary, occasionally they are necessary and sufficient or just sufficient. Often they use terms that are not themselves defined and so they effectively can&apos;t be evaluated by those criteria.
70
+
71
+ On the specifics of the proposed definition:
72
+
73
+ We don&apos;t have definitions of &apos;meaning&apos; or &apos;expression&apos; or &apos;property&apos;. For &apos;reference&apos; in the intended sense I think we use the term &apos;denotation&apos;. For &apos;expression&apos;, I think we you mean symbol, or identifier. For &apos;meaning&apos; it differs for class and property. For class we want documentation that let&apos;s the intended reader determine whether an entity is instance of the class, or not. For property we want documentation that let&apos;s the intended reader determine, given a pair of potential relata, whether the assertion that the relation holds is true. The &apos;intended reader&apos; part suggests that we also specify who, we expect, would be able to understand the definition, and also generalizes over human and computer reader to include textual and logical definition.
74
+
75
+ Personally, I am more comfortable weakening definition to documentation, with instructions as to what is desirable.
76
+
77
+ We also have the outstanding issue of how to aim different definitions to different audiences. A clinical audience reading chebi wants a different sort of definition documentation/definition from a chemistry trained audience, and similarly there is a need for a definition that is adequate for an ontologist to work with. </obo:IAO_0000116>
78
+ <obo:IAO_0000117 xml:lang="en">PERSON:Daniel Schober</obo:IAO_0000117>
79
+ <obo:IAO_0000119 xml:lang="en">GROUP:OBI:&lt;http://purl.obolibrary.org/obo/obi&gt;</obo:IAO_0000119>
80
+ <rdfs:isDefinedBy rdf:resource="http://purl.obolibrary.org/obo/iao.owl"/>
81
+ <rdfs:label xml:lang="en">definition</rdfs:label>
82
+ </owl:AnnotationProperty>
83
+
84
+
85
+
86
+ <!-- http://purl.obolibrary.org/obo/IAO_0000116 -->
87
+
88
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000116"/>
89
+
90
+
91
+
92
+ <!-- http://purl.obolibrary.org/obo/IAO_0000117 -->
93
+
94
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000117"/>
95
+
96
+
97
+
98
+ <!-- http://purl.obolibrary.org/obo/IAO_0000119 -->
99
+
100
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000119">
101
+ <obo:IAO_0000111 xml:lang="en">definition source</obo:IAO_0000111>
102
+ <obo:IAO_0000114 rdf:resource="http://purl.obolibrary.org/obo/IAO_0000122"/>
103
+ <obo:IAO_0000115 xml:lang="en">Formal citation, e.g. identifier in external database to indicate / attribute source(s) for the definition. Free text indicate / attribute source(s) for the definition. EXAMPLE: Author Name, URI, MeSH Term C04, PUBMED ID, Wiki uri on 31.01.2007</obo:IAO_0000115>
104
+ <obo:IAO_0000117 xml:lang="en">PERSON:Daniel Schober</obo:IAO_0000117>
105
+ <obo:IAO_0000119 xml:lang="en">Discussion on obo-discuss mailing-list, see http://bit.ly/hgm99w</obo:IAO_0000119>
106
+ <obo:IAO_0000119 xml:lang="en">GROUP:OBI:&lt;http://purl.obolibrary.org/obo/obi&gt;</obo:IAO_0000119>
107
+ <rdfs:isDefinedBy rdf:resource="http://purl.obolibrary.org/obo/iao.owl"/>
108
+ <rdfs:label xml:lang="en">definition source</rdfs:label>
109
+ </owl:AnnotationProperty>
110
+
111
+
112
+
113
+ <!-- http://purl.org/dc/elements/1.1/contributor -->
114
+
115
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/contributor"/>
116
+
117
+
118
+
119
+ <!-- http://purl.org/dc/elements/1.1/creator -->
120
+
121
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/creator"/>
122
+
123
+
124
+
125
+ <!-- http://purl.org/dc/elements/1.1/description -->
126
+
127
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/description"/>
128
+
129
+
130
+
131
+ <!-- http://purl.org/dc/elements/1.1/title -->
132
+
133
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/title"/>
134
+
135
+
136
+
137
+ <!-- http://purl.org/dc/terms/contributor -->
138
+
139
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/contributor">
140
+ <rdfs:comment xml:lang="en-us">Examples of a Contributor include a person, an organization, or a service. Typically, the name of a Contributor should be used to indicate the entity.</rdfs:comment>
141
+ <rdfs:label xml:lang="en-us">Contributor</rdfs:label>
142
+ <skos:definition xml:lang="en-us">An entity responsible for making contributions to the resource.</skos:definition>
143
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/contributor"/>
144
+ </owl:AnnotationProperty>
145
+
146
+
147
+
148
+ <!-- http://purl.org/dc/terms/creator -->
149
+
150
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/creator">
151
+ <rdfs:comment xml:lang="en-us">Examples of a Creator include a person, an organization, or a service. Typically, the name of a Creator should be used to indicate the entity.</rdfs:comment>
152
+ <rdfs:label xml:lang="en-us">Creator</rdfs:label>
153
+ <skos:definition xml:lang="en-us">An entity primarily responsible for making the resource.</skos:definition>
154
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/creator"/>
155
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/terms/contributor"/>
156
+ <rdfs:range rdf:resource="http://purl.org/dc/terms/Agent"/>
157
+ </owl:AnnotationProperty>
158
+
159
+
160
+
161
+ <!-- http://purl.org/dc/terms/description -->
162
+
163
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/description">
164
+ <rdfs:comment xml:lang="en-us">Description may include but is not limited to: an abstract, a table of contents, a graphical representation, or a free-text account of the resource.</rdfs:comment>
165
+ <rdfs:label xml:lang="en-us">Description</rdfs:label>
166
+ <skos:definition xml:lang="en-us">An account of the resource.</skos:definition>
167
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/description"/>
168
+ </owl:AnnotationProperty>
169
+
170
+
171
+
172
+ <!-- http://purl.org/dc/terms/title -->
173
+
174
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/title">
175
+ <rdfs:label xml:lang="en-us">Title</rdfs:label>
176
+ <skos:definition xml:lang="en-us">A name given to the resource.</skos:definition>
177
+ <skos:note xml:lang="en-us">In current practice, this term is used primarily with literal values; however, there are important uses with non-literal values as well. As of December 2007, the DCMI Usage Board is leaving this range unspecified pending an investigation of options.</skos:note>
178
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/title"/>
179
+ </owl:AnnotationProperty>
180
+
181
+
182
+
183
+ <!-- http://www.w3.org/2004/02/skos/core#altLabel -->
184
+
185
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#altLabel">
186
+ <rdfs:comment xml:lang="en">The range of skos:altLabel is the class of RDF plain literals.</rdfs:comment>
187
+ <rdfs:comment xml:lang="en">skos:prefLabel, skos:altLabel and skos:hiddenLabel are pairwise disjoint properties.</rdfs:comment>
188
+ <rdfs:isDefinedBy rdf:resource="http://www.w3.org/2004/02/skos/core"/>
189
+ <rdfs:label xml:lang="en">alternative label</rdfs:label>
190
+ <skos:definition xml:lang="en">An alternative lexical label for a resource.</skos:definition>
191
+ <skos:example xml:lang="en">Acronyms, abbreviations, spelling variants, and irregular plural/singular forms may be included among the alternative labels for a concept. Mis-spelled terms are normally included as hidden labels (see skos:hiddenLabel).</skos:example>
192
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2000/01/rdf-schema#label"/>
193
+ </owl:AnnotationProperty>
194
+
195
+
196
+
197
+ <!-- http://www.w3.org/2004/02/skos/core#definition -->
198
+
199
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#definition">
200
+ <rdfs:isDefinedBy rdf:resource="http://www.w3.org/2004/02/skos/core"/>
201
+ <rdfs:label xml:lang="en">definition</rdfs:label>
202
+ <skos:definition xml:lang="en">A statement or formal explanation of the meaning of a concept.</skos:definition>
203
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2004/02/skos/core#note"/>
204
+ </owl:AnnotationProperty>
205
+
206
+
207
+
208
+ <!-- http://www.w3.org/2004/02/skos/core#example -->
209
+
210
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#example">
211
+ <rdfs:isDefinedBy rdf:resource="http://www.w3.org/2004/02/skos/core"/>
212
+ <rdfs:label xml:lang="en">example</rdfs:label>
213
+ <skos:definition xml:lang="en">An example of the use of a concept.</skos:definition>
214
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2004/02/skos/core#note"/>
215
+ </owl:AnnotationProperty>
216
+
217
+
218
+
219
+ <!-- http://www.w3.org/2004/02/skos/core#note -->
220
+
221
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#note">
222
+ <skos:definition xml:lang="en">A general note, for any purpose.</skos:definition>
223
+ </owl:AnnotationProperty>
224
+
225
+
226
+
227
+ <!-- http://www.w3.org/2004/02/skos/core#prefLabel -->
228
+
229
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#prefLabel">
230
+ <rdfs:comment xml:lang="en">A resource has no more than one value of skos:prefLabel per language tag, and no more than one value of skos:prefLabel without language tag.</rdfs:comment>
231
+ <rdfs:comment xml:lang="en">The range of skos:prefLabel is the class of RDF plain literals.</rdfs:comment>
232
+ <rdfs:comment xml:lang="en">skos:prefLabel, skos:altLabel and skos:hiddenLabel are pairwise
233
+ disjoint properties.</rdfs:comment>
234
+ <rdfs:isDefinedBy rdf:resource="http://www.w3.org/2004/02/skos/core"/>
235
+ <rdfs:label xml:lang="en">preferred label</rdfs:label>
236
+ <skos:definition xml:lang="en">The preferred lexical label for a resource, in a given language.</skos:definition>
237
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2000/01/rdf-schema#label"/>
238
+ </owl:AnnotationProperty>
239
+
240
+
241
+
242
+ <!-- https://schema.org/citation -->
243
+
244
+ <owl:AnnotationProperty rdf:about="https://schema.org/citation"/>
245
+
246
+
247
+
248
+ <!-- https://schema.org/creativeWorkStatus -->
249
+
250
+ <owl:AnnotationProperty rdf:about="https://schema.org/creativeWorkStatus"/>
251
+
252
+
253
+
254
+ <!-- https://schema.org/funder -->
255
+
256
+ <owl:AnnotationProperty rdf:about="https://schema.org/funder"/>
257
+
258
+
259
+
260
+ <!-- https://schema.org/logo -->
261
+
262
+ <owl:AnnotationProperty rdf:about="https://schema.org/logo"/>
263
+
264
+
265
+
266
+ <!--
267
+ ///////////////////////////////////////////////////////////////////////////////////////
268
+ //
269
+ // Object Properties
270
+ //
271
+ ///////////////////////////////////////////////////////////////////////////////////////
272
+ -->
273
+
274
+
275
+
276
+
277
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/hasCrystallographicDefect -->
278
+
279
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/hasCrystallographicDefect">
280
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallineMaterial"/>
281
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect"/>
282
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a crystalline material and a crystallographic defect, such as vacancies, interstitials, or dislocations.</obo:IAO_0000115>
283
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has crystallographic defect</rdfs:label>
284
+ </owl:ObjectProperty>
285
+
286
+
287
+
288
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/hasDefectComplex -->
289
+
290
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/hasDefectComplex">
291
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallineMaterial"/>
292
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/DefectComplex"/>
293
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a crystalline material to a specific defect complex, which consists of two or more interacting defects.</obo:IAO_0000115>
294
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has defect complex</rdfs:label>
295
+ </owl:ObjectProperty>
296
+
297
+
298
+
299
+ <!--
300
+ ///////////////////////////////////////////////////////////////////////////////////////
301
+ //
302
+ // Classes
303
+ //
304
+ ///////////////////////////////////////////////////////////////////////////////////////
305
+ -->
306
+
307
+
308
+
309
+
310
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallineMaterial -->
311
+
312
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallineMaterial">
313
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/Material"/>
314
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Crystalline material is material characterized by a periodic arrangement of the constituent atoms. The arrangement could be described its crystal structure.</obo:IAO_0000115>
315
+ <rdfs:label>Crystalline Material</rdfs:label>
316
+ </owl:Class>
317
+
318
+
319
+
320
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect -->
321
+
322
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect">
323
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Lattice irregularity having one or more of its dimensions on the order of an atomic diameter.</obo:IAO_0000115>
324
+ <rdfs:label>Crystallographic Defect</rdfs:label>
325
+ </owl:Class>
326
+
327
+
328
+
329
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/DefectComplex -->
330
+
331
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/DefectComplex">
332
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A combination of two or more defects in close proximity that interact with each other, such as a vacancy-impurity pair or a grain boundary-impurity pair, often affecting the material’s properties.</obo:IAO_0000115>
333
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Defect Complex</rdfs:label>
334
+ <skos:altLabel rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Defect Cluster</skos:altLabel>
335
+ </owl:Class>
336
+
337
+
338
+
339
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/Material -->
340
+
341
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/Material">
342
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Materials are substances in the condensed states (liquid, solid, colloidal) designed or manipulated for technological ends.</obo:IAO_0000115>
343
+ <obo:IAO_0000119 rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://web.archive.org/web/20100801234616/http://www.nature.com/nmat/authors/index.html</obo:IAO_0000119>
344
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Material</rdfs:label>
345
+ </owl:Class>
346
+
347
+
348
+
349
+ <!-- http://purls.helmholtz-metadaten.de/cdos/ldo/LineDefect -->
350
+
351
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/ldo/LineDefect">
352
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect"/>
353
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Linear or one-dimensional defect around which some of the atoms are misaligned.</obo:IAO_0000115>
354
+ <rdfs:label>Line Defect</rdfs:label>
355
+ </owl:Class>
356
+
357
+
358
+
359
+ <!-- http://purls.helmholtz-metadaten.de/cdos/pldo/PlanarDefect -->
360
+
361
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/pldo/PlanarDefect">
362
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect"/>
363
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A planar defect is a defect of the crystal structure across a plane. It is considered to be a two-dimensional defect, such as an internal interface or the surface.</obo:IAO_0000115>
364
+ <rdfs:label>Planar Defect</rdfs:label>
365
+ <skos:altLabel>Interface</skos:altLabel>
366
+ </owl:Class>
367
+
368
+
369
+
370
+ <!-- http://purls.helmholtz-metadaten.de/cdos/podo/PointDefect -->
371
+
372
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/podo/PointDefect">
373
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect"/>
374
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A point defect is a crystalline defect which is localized at or around a single lattice point. It is considered to be a zero-dimensional defect because it does not extend in any dimension in the lattice.</obo:IAO_0000115>
375
+ <rdfs:label>Point Defect</rdfs:label>
376
+ </owl:Class>
377
+ </rdf:RDF>
378
+
379
+
380
+
381
+ <!-- Generated by the OWL API (version 4.5.9.2019-02-01T07:24:44Z) https://github.com/owlcs/owlapi -->
382
+
cdco/cdco.rst ADDED
@@ -0,0 +1,69 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Crystallographic Defect Core Ontology (CDCO)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ CDCO defines the common terminology shared across all types of crystallographic defects,
7
+ providing a unified framework for data integration in materials science.
8
+
9
+ :Domain: Materials Science and Engineering
10
+ :Category: Materials Science
11
+ :Current Version: 1.0.0
12
+ :Last Updated: None
13
+ :Creator: https://orcid.org/0000-0001-7564-7990
14
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
15
+ :Format: OWL
16
+ :Download: `Crystallographic Defect Core Ontology (CDCO) Homepage <https://github.com/OCDO/cdco>`_
17
+
18
+ Graph Metrics
19
+ -------------
20
+ - **Total Nodes**: 85
21
+ - **Total Edges**: 123
22
+ - **Root Nodes**: 8
23
+ - **Leaf Nodes**: 53
24
+
25
+ Knowledge coverage
26
+ ------------------
27
+ - Classes: 7
28
+ - Individuals: 0
29
+ - Properties: 2
30
+
31
+ Hierarchical metrics
32
+ --------------------
33
+ - **Maximum Depth**: 1
34
+ - **Minimum Depth**: 0
35
+ - **Average Depth**: 0.11
36
+ - **Depth Variance**: 0.10
37
+
38
+ Breadth metrics
39
+ ------------------
40
+ - **Maximum Breadth**: 8
41
+ - **Minimum Breadth**: 1
42
+ - **Average Breadth**: 4.50
43
+ - **Breadth Variance**: 12.25
44
+
45
+ Dataset Statistics
46
+ ------------------
47
+ Generated Benchmarks:
48
+ - **Term Types**: 0
49
+ - **Taxonomic Relations**: 4
50
+ - **Non-taxonomic Relations**: 0
51
+ - **Average Terms per Type**: 0.00
52
+
53
+ Usage Example
54
+ -------------
55
+ .. code-block:: python
56
+
57
+ from ontolearner.ontology import CDCO
58
+
59
+ # Initialize and load ontology
60
+ ontology = CDCO()
61
+ ontology.load("path/to/ontology.OWL")
62
+
63
+ # Extract datasets
64
+ data = ontology.extract()
65
+
66
+ # Access specific relations
67
+ term_types = data.term_typings
68
+ taxonomic_relations = data.type_taxonomies
69
+ non_taxonomic_relations = data.type_non_taxonomic_relations
cdco/term_typings.json ADDED
@@ -0,0 +1 @@
 
 
1
+ []
cdco/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,5 @@
 
 
 
 
 
 
1
+ {
2
+ "types": [],
3
+ "relations": [],
4
+ "non_taxonomies": []
5
+ }
cdco/type_taxonomies.json ADDED
@@ -0,0 +1,32 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "Material",
4
+ "Crystalline Material",
5
+ "Planar Defect",
6
+ "Crystallographic Defect",
7
+ "Line Defect",
8
+ "Point Defect"
9
+ ],
10
+ "taxonomies": [
11
+ {
12
+ "ID": "TR_b926aa1f",
13
+ "parent": "Material",
14
+ "child": "Crystalline Material"
15
+ },
16
+ {
17
+ "ID": "TR_d0a04b41",
18
+ "parent": "Crystallographic Defect",
19
+ "child": "Line Defect"
20
+ },
21
+ {
22
+ "ID": "TR_16569cc1",
23
+ "parent": "Crystallographic Defect",
24
+ "child": "Planar Defect"
25
+ },
26
+ {
27
+ "ID": "TR_521b643a",
28
+ "parent": "Crystallographic Defect",
29
+ "child": "Point Defect"
30
+ }
31
+ ]
32
+ }
chameo/chameo.rst ADDED
@@ -0,0 +1,72 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Characterisation Methodology Domain Ontology (CHAMEO)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ An ontology for materials characterization which represents the evolution of the CHADA template
7
+ in an ontological form, allowing to generate FAIR documentation of Characterisation Experiments
8
+ and that has been used as a basis for the development of a number of technique-specific
9
+ or application-specific ontologies in the materials characterisation domain. CHAMEO
10
+ has been used as a foundation for the definition of the new CHADA template during the CWA.
11
+
12
+ :Domain: Materials Science and Engineering
13
+ :Category: Materials Science
14
+ :Current Version: 1.0.0
15
+ :Last Updated: 2024-04-12
16
+ :Creator: https://orcid.org/0000-0002-4181-2852, https://orcid.org/0000-0002-5174-8508, https://orcid.org/0000-0002-9668-6961
17
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
18
+ :Format: TTL
19
+ :Download: `Characterisation Methodology Domain Ontology (CHAMEO) Homepage <https://github.com/emmo-repo/domain-characterisation-methodology>`_
20
+
21
+ Graph Metrics
22
+ -------------
23
+ - **Total Nodes**: 802
24
+ - **Total Edges**: 1526
25
+ - **Root Nodes**: 29
26
+ - **Leaf Nodes**: 459
27
+
28
+ Knowledge coverage
29
+ ------------------
30
+ - Classes: 203
31
+ - Individuals: 0
32
+ - Properties: 52
33
+
34
+ Hierarchical metrics
35
+ --------------------
36
+ - **Maximum Depth**: 12
37
+ - **Minimum Depth**: 0
38
+ - **Average Depth**: 4.25
39
+ - **Depth Variance**: 8.29
40
+
41
+ Breadth metrics
42
+ ------------------
43
+ - **Maximum Breadth**: 45
44
+ - **Minimum Breadth**: 2
45
+ - **Average Breadth**: 19.92
46
+ - **Breadth Variance**: 154.69
47
+
48
+ Dataset Statistics
49
+ ------------------
50
+ Generated Benchmarks:
51
+ - **Term Types**: 0
52
+ - **Taxonomic Relations**: 195
53
+ - **Non-taxonomic Relations**: 2
54
+ - **Average Terms per Type**: 0.00
55
+
56
+ Usage Example
57
+ -------------
58
+ .. code-block:: python
59
+
60
+ from ontolearner.ontology import CHAMEO
61
+
62
+ # Initialize and load ontology
63
+ ontology = CHAMEO()
64
+ ontology.load("path/to/ontology.TTL")
65
+
66
+ # Extract datasets
67
+ data = ontology.extract()
68
+
69
+ # Access specific relations
70
+ term_types = data.term_typings
71
+ taxonomic_relations = data.type_taxonomies
72
+ non_taxonomic_relations = data.type_non_taxonomic_relations
chameo/chameo.ttl ADDED
The diff for this file is too large to render. See raw diff
 
chameo/term_typings.json ADDED
@@ -0,0 +1 @@
 
 
1
+ []
chameo/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,25 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "HardwareManufacturer",
4
+ "HardwareModel",
5
+ "PreparedSample",
6
+ "ReferenceSample"
7
+ ],
8
+ "relations": [
9
+ "disjointWith"
10
+ ],
11
+ "non_taxonomies": [
12
+ {
13
+ "ID": "NR_553018d1",
14
+ "head": "PreparedSample",
15
+ "tail": "ReferenceSample",
16
+ "relation": "disjointWith"
17
+ },
18
+ {
19
+ "ID": "NR_9afbc802",
20
+ "head": "HardwareManufacturer",
21
+ "tail": "HardwareModel",
22
+ "relation": "disjointWith"
23
+ }
24
+ ]
25
+ }
chameo/type_taxonomies.json ADDED
@@ -0,0 +1,1151 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "EnergyDispersiveXraySpectroscopy",
4
+ "SampleExtractionInstrument",
5
+ "LinearScanVoltammetry",
6
+ "CyclicChronopotentiometry",
7
+ "DeviceSample",
8
+ "ElectrochemicalTesting",
9
+ "UltrasonicTesting",
10
+ "HPPC",
11
+ "Signal",
12
+ "DataNormalisation",
13
+ "ICI",
14
+ "ACVoltammetry",
15
+ "FourierTransformInfraredSpectroscopy",
16
+ "SampledDCPolarography",
17
+ "ScanningProbeMicroscopy",
18
+ "SampleExtraction",
19
+ "WearTesting",
20
+ "ChargeDistribution",
21
+ "Exafs",
22
+ "DifferentialScanningCalorimetry",
23
+ "Chronocoulometry",
24
+ "Thermogravimetry",
25
+ "LinearChronopotentiometry",
26
+ "ThermochemicalTesting",
27
+ "AdsorptiveStrippingVoltammetry",
28
+ "SamplePreparationInstrument",
29
+ "StepChronopotentiometry",
30
+ "RawData",
31
+ "CharacterisationProcedure",
32
+ "GasAdsorptionPorosimetry",
33
+ "SquareWaveVoltammetry",
34
+ "Synchrotron",
35
+ "VaporPressureDepressionOsmometry",
36
+ "CathodicStrippingVoltammetry",
37
+ "FreezingPointDepressionOsmometry",
38
+ "BrunauerEmmettTellerMethod",
39
+ "DataPreparation",
40
+ "Conductometry",
41
+ "Osmometry",
42
+ "CriticalAndSupercriticalChromatography",
43
+ "AnodicStrippingVoltammetry",
44
+ "CyclicVoltammetry",
45
+ "Spectroscopy",
46
+ "Impedimetry",
47
+ "CompressionTesting",
48
+ "DynamicLightScattering",
49
+ "IntermediateSample",
50
+ "DifferentialStaircasePulseVoltammetry",
51
+ "RamanSpectroscopy",
52
+ "Viscometry",
53
+ "PseudoOpenCircuitVoltageMethod",
54
+ "Nanoindentation",
55
+ "SecondaryIonMassSpectrometry",
56
+ "DielectricAndImpedanceSpectroscopy",
57
+ "SecondaryData",
58
+ "OutlierRemoval",
59
+ "CharacterisationHardware",
60
+ "Ellipsometry",
61
+ "OpticalTesting",
62
+ "MechanicalTesting",
63
+ "StrippingVoltammetry",
64
+ "PhotoluminescenceMicroscopy",
65
+ "CalibrationData",
66
+ "SampleInspection",
67
+ "Chronoamperometry",
68
+ "CharacterisationMeasurementProcess",
69
+ "CharacterisationHardwareSpecification",
70
+ "MembraneOsmometry",
71
+ "Polishing",
72
+ "Holder",
73
+ "XrayPowderDiffraction",
74
+ "Microscopy",
75
+ "ElectrochemicalPiezoelectricMicrogravimetry",
76
+ "PulsedElectroacousticMethod",
77
+ "Chromatography",
78
+ "HardwareModel",
79
+ "Sample",
80
+ "ElectronBackscatterDiffraction",
81
+ "DirectCoulometryAtControlledPotential",
82
+ "ScanningKelvinProbe",
83
+ "GalvanostaticIntermittentTitrationTechnique",
84
+ "Spectrometry",
85
+ "IsothermalMicrocalorimetry",
86
+ "AlphaSpectrometry",
87
+ "PrimaryData",
88
+ "ElectrochemicalImpedanceSpectroscopy",
89
+ "ConfocalMicroscopy",
90
+ "SamplePreparation",
91
+ "Chronopotentiometry",
92
+ "ShearOrTorsionTesting",
93
+ "ScanningTunnelingMicroscopy",
94
+ "OpenCircuitHold",
95
+ "DCPolarography",
96
+ "DirectCurrentInternalResistance",
97
+ "IonMobilitySpectrometry",
98
+ "ElectronProbeMicroanalysis",
99
+ "MassSpectrometry",
100
+ "CharacterisationTechnique",
101
+ "Coulometry",
102
+ "DynamicMechanicalSpectroscopy",
103
+ "HydrodynamicVoltammetry",
104
+ "Profilometry",
105
+ "DirectCoulometryAtControlledCurrent",
106
+ "Probe",
107
+ "MercuryPorosimetry",
108
+ "DifferentialLinearPulseVoltammetry",
109
+ "DataFiltering",
110
+ "DynamicMechanicalAnalysis",
111
+ "Potentiometry",
112
+ "MeasurementSystemAdjustment",
113
+ "DifferentialPulseVoltammetry",
114
+ "XrayDiffraction",
115
+ "Voltammetry",
116
+ "TransmissionElectronMicroscopy",
117
+ "CharacterisationProtocol",
118
+ "EnvironmentalScanningElectronMicroscopy",
119
+ "CharacterisedSample",
120
+ "FieldEmissionScanningElectronMicroscopy",
121
+ "CharacterisationMeasurementInstrument",
122
+ "HardnessTesting",
123
+ "ThreePointBendingTesting",
124
+ "AbrasiveStrippingVoltammetry",
125
+ "Dilatometry",
126
+ "Fractography",
127
+ "DifferentialThermalAnalysis",
128
+ "XrdGrazingIncidence",
129
+ "CharacterisationData",
130
+ "ScanningAugerElectronMicroscopy",
131
+ "FatigueTesting",
132
+ "PotentiometricStrippingAnalysis",
133
+ "AtomicForceMicroscopy",
134
+ "XpsVariableKinetic",
135
+ "Calorimetry",
136
+ "CreepTesting",
137
+ "LightScattering",
138
+ "SampleInspectionInstrument",
139
+ "DifferentialRefractiveIndex",
140
+ "Electrogravimetry",
141
+ "SamplePreparationByCutting",
142
+ "Dielectrometry",
143
+ "TensileTesting",
144
+ "UltravioletVisibleSpectroscopy",
145
+ "NormalPulseVoltammetry",
146
+ "RawSample",
147
+ "Nexafs",
148
+ "VoltammetryAtARotatingDiskElectrode",
149
+ "Amperometry",
150
+ "OpticalMicroscopy",
151
+ "Grinding",
152
+ "HardwareManufacturer",
153
+ "FibDic",
154
+ "Milling",
155
+ "NuclearMagneticResonance",
156
+ "ScanningElectronMicroscopy",
157
+ "CoulometricTitration",
158
+ "ConductometricTitration",
159
+ "ReferenceSample",
160
+ "AtomProbeTomography",
161
+ "Porosimetry",
162
+ "ScatteringAndDiffraction",
163
+ "CalibrationProcess",
164
+ "NeutronSpinEchoSpectroscopy",
165
+ "Mounting",
166
+ "SampleExtractionByCutting",
167
+ "Detector",
168
+ "GammaSpectrometry",
169
+ "AnalyticalElectronMicroscopy",
170
+ "Tomography",
171
+ "PreparedSample",
172
+ "IonChromatography"
173
+ ],
174
+ "taxonomies": [
175
+ {
176
+ "ID": "TR_00e03c28",
177
+ "parent": "Voltammetry",
178
+ "child": "ACVoltammetry"
179
+ },
180
+ {
181
+ "ID": "TR_a46923d1",
182
+ "parent": "Voltammetry",
183
+ "child": "AbrasiveStrippingVoltammetry"
184
+ },
185
+ {
186
+ "ID": "TR_e32a2e1e",
187
+ "parent": "Voltammetry",
188
+ "child": "CyclicVoltammetry"
189
+ },
190
+ {
191
+ "ID": "TR_557a7a9d",
192
+ "parent": "Voltammetry",
193
+ "child": "DCPolarography"
194
+ },
195
+ {
196
+ "ID": "TR_063acbb4",
197
+ "parent": "Voltammetry",
198
+ "child": "DifferentialPulseVoltammetry"
199
+ },
200
+ {
201
+ "ID": "TR_be06b3b3",
202
+ "parent": "Voltammetry",
203
+ "child": "HydrodynamicVoltammetry"
204
+ },
205
+ {
206
+ "ID": "TR_eec6dc3b",
207
+ "parent": "Voltammetry",
208
+ "child": "LinearScanVoltammetry"
209
+ },
210
+ {
211
+ "ID": "TR_9cdac9c2",
212
+ "parent": "Voltammetry",
213
+ "child": "NormalPulseVoltammetry"
214
+ },
215
+ {
216
+ "ID": "TR_300b4d8a",
217
+ "parent": "Voltammetry",
218
+ "child": "PotentiometricStrippingAnalysis"
219
+ },
220
+ {
221
+ "ID": "TR_1e4ae58f",
222
+ "parent": "Voltammetry",
223
+ "child": "SquareWaveVoltammetry"
224
+ },
225
+ {
226
+ "ID": "TR_9392191e",
227
+ "parent": "Voltammetry",
228
+ "child": "StrippingVoltammetry"
229
+ },
230
+ {
231
+ "ID": "TR_b3bf4e0e",
232
+ "parent": "StrippingVoltammetry",
233
+ "child": "AdsorptiveStrippingVoltammetry"
234
+ },
235
+ {
236
+ "ID": "TR_1ae8f77d",
237
+ "parent": "StrippingVoltammetry",
238
+ "child": "AnodicStrippingVoltammetry"
239
+ },
240
+ {
241
+ "ID": "TR_112b6803",
242
+ "parent": "StrippingVoltammetry",
243
+ "child": "CathodicStrippingVoltammetry"
244
+ },
245
+ {
246
+ "ID": "TR_6d93d6f5",
247
+ "parent": "Spectrometry",
248
+ "child": "AlphaSpectrometry"
249
+ },
250
+ {
251
+ "ID": "TR_8279f427",
252
+ "parent": "Spectrometry",
253
+ "child": "GammaSpectrometry"
254
+ },
255
+ {
256
+ "ID": "TR_c9111a83",
257
+ "parent": "Spectrometry",
258
+ "child": "IonMobilitySpectrometry"
259
+ },
260
+ {
261
+ "ID": "TR_26d01384",
262
+ "parent": "Spectrometry",
263
+ "child": "MassSpectrometry"
264
+ },
265
+ {
266
+ "ID": "TR_ddda38fd",
267
+ "parent": "Spectrometry",
268
+ "child": "SecondaryIonMassSpectrometry"
269
+ },
270
+ {
271
+ "ID": "TR_46cf0e23",
272
+ "parent": "ElectrochemicalTesting",
273
+ "child": "Amperometry"
274
+ },
275
+ {
276
+ "ID": "TR_293a700f",
277
+ "parent": "ElectrochemicalTesting",
278
+ "child": "Conductometry"
279
+ },
280
+ {
281
+ "ID": "TR_e8abc9e5",
282
+ "parent": "ElectrochemicalTesting",
283
+ "child": "Coulometry"
284
+ },
285
+ {
286
+ "ID": "TR_59241779",
287
+ "parent": "ElectrochemicalTesting",
288
+ "child": "Dielectrometry"
289
+ },
290
+ {
291
+ "ID": "TR_4f0f8547",
292
+ "parent": "ElectrochemicalTesting",
293
+ "child": "Electrogravimetry"
294
+ },
295
+ {
296
+ "ID": "TR_2928308d",
297
+ "parent": "ElectrochemicalTesting",
298
+ "child": "Impedimetry"
299
+ },
300
+ {
301
+ "ID": "TR_b276f714",
302
+ "parent": "ElectrochemicalTesting",
303
+ "child": "Potentiometry"
304
+ },
305
+ {
306
+ "ID": "TR_ca0c8070",
307
+ "parent": "ElectrochemicalTesting",
308
+ "child": "Voltammetry"
309
+ },
310
+ {
311
+ "ID": "TR_dedeb6b1",
312
+ "parent": "Microscopy",
313
+ "child": "AnalyticalElectronMicroscopy"
314
+ },
315
+ {
316
+ "ID": "TR_d3002aae",
317
+ "parent": "Microscopy",
318
+ "child": "AtomicForceMicroscopy"
319
+ },
320
+ {
321
+ "ID": "TR_fc37c773",
322
+ "parent": "Microscopy",
323
+ "child": "ConfocalMicroscopy"
324
+ },
325
+ {
326
+ "ID": "TR_4d9ccb2a",
327
+ "parent": "Microscopy",
328
+ "child": "ElectronProbeMicroanalysis"
329
+ },
330
+ {
331
+ "ID": "TR_1d3b10f2",
332
+ "parent": "Microscopy",
333
+ "child": "EnvironmentalScanningElectronMicroscopy"
334
+ },
335
+ {
336
+ "ID": "TR_3f230aa6",
337
+ "parent": "Microscopy",
338
+ "child": "FieldEmissionScanningElectronMicroscopy"
339
+ },
340
+ {
341
+ "ID": "TR_dc386e81",
342
+ "parent": "Microscopy",
343
+ "child": "OpticalMicroscopy"
344
+ },
345
+ {
346
+ "ID": "TR_c2e752aa",
347
+ "parent": "Microscopy",
348
+ "child": "PhotoluminescenceMicroscopy"
349
+ },
350
+ {
351
+ "ID": "TR_ca356f19",
352
+ "parent": "Microscopy",
353
+ "child": "ScanningAugerElectronMicroscopy"
354
+ },
355
+ {
356
+ "ID": "TR_1e55cae6",
357
+ "parent": "Microscopy",
358
+ "child": "ScanningElectronMicroscopy"
359
+ },
360
+ {
361
+ "ID": "TR_c2012fd6",
362
+ "parent": "Microscopy",
363
+ "child": "ScanningKelvinProbe"
364
+ },
365
+ {
366
+ "ID": "TR_624c207a",
367
+ "parent": "Microscopy",
368
+ "child": "ScanningProbeMicroscopy"
369
+ },
370
+ {
371
+ "ID": "TR_0e243c51",
372
+ "parent": "Microscopy",
373
+ "child": "ScanningTunnelingMicroscopy"
374
+ },
375
+ {
376
+ "ID": "TR_914f19f7",
377
+ "parent": "Microscopy",
378
+ "child": "TransmissionElectronMicroscopy"
379
+ },
380
+ {
381
+ "ID": "TR_2171341a",
382
+ "parent": "Tomography",
383
+ "child": "AtomProbeTomography"
384
+ },
385
+ {
386
+ "ID": "TR_9ae9ce67",
387
+ "parent": "GasAdsorptionPorosimetry",
388
+ "child": "BrunauerEmmettTellerMethod"
389
+ },
390
+ {
391
+ "ID": "TR_25c536d9",
392
+ "parent": "CharacterisationData",
393
+ "child": "CalibrationData"
394
+ },
395
+ {
396
+ "ID": "TR_f386746e",
397
+ "parent": "CharacterisationData",
398
+ "child": "PrimaryData"
399
+ },
400
+ {
401
+ "ID": "TR_83993af9",
402
+ "parent": "CharacterisationData",
403
+ "child": "RawData"
404
+ },
405
+ {
406
+ "ID": "TR_35dbcc09",
407
+ "parent": "CharacterisationData",
408
+ "child": "SecondaryData"
409
+ },
410
+ {
411
+ "ID": "TR_b36bf8d8",
412
+ "parent": "CharacterisationData",
413
+ "child": "Signal"
414
+ },
415
+ {
416
+ "ID": "TR_7818fe2d",
417
+ "parent": "CharacterisationProcedure",
418
+ "child": "CalibrationProcess"
419
+ },
420
+ {
421
+ "ID": "TR_8d8095b8",
422
+ "parent": "CharacterisationProcedure",
423
+ "child": "CharacterisationMeasurementProcess"
424
+ },
425
+ {
426
+ "ID": "TR_925ca709",
427
+ "parent": "CharacterisationProcedure",
428
+ "child": "CharacterisationProtocol"
429
+ },
430
+ {
431
+ "ID": "TR_741cec42",
432
+ "parent": "CharacterisationProcedure",
433
+ "child": "MeasurementSystemAdjustment"
434
+ },
435
+ {
436
+ "ID": "TR_2cee9c58",
437
+ "parent": "CharacterisationProcedure",
438
+ "child": "SampleExtraction"
439
+ },
440
+ {
441
+ "ID": "TR_1a84eb46",
442
+ "parent": "CharacterisationProcedure",
443
+ "child": "SampleInspection"
444
+ },
445
+ {
446
+ "ID": "TR_8ca53edb",
447
+ "parent": "CharacterisationProcedure",
448
+ "child": "SamplePreparation"
449
+ },
450
+ {
451
+ "ID": "TR_01de90d6",
452
+ "parent": "CharacterisationProcedure",
453
+ "child": "CalibrationProcess"
454
+ },
455
+ {
456
+ "ID": "TR_fc2565e4",
457
+ "parent": "CharacterisationProcedure",
458
+ "child": "CalibrationProcess"
459
+ },
460
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+ "child": "SampleInspection"
1099
+ },
1100
+ {
1101
+ "ID": "TR_adac564f",
1102
+ "parent": "CharacterisationProcedure",
1103
+ "child": "SampleInspection"
1104
+ },
1105
+ {
1106
+ "ID": "TR_8ab57a6e",
1107
+ "parent": "CharacterisationProcedure",
1108
+ "child": "SampleInspection"
1109
+ },
1110
+ {
1111
+ "ID": "TR_d36a1414",
1112
+ "parent": "CharacterisationProcedure",
1113
+ "child": "SampleInspection"
1114
+ },
1115
+ {
1116
+ "ID": "TR_e09eefc3",
1117
+ "parent": "CharacterisationProcedure",
1118
+ "child": "SamplePreparation"
1119
+ },
1120
+ {
1121
+ "ID": "TR_888f46e4",
1122
+ "parent": "CharacterisationProcedure",
1123
+ "child": "SamplePreparation"
1124
+ },
1125
+ {
1126
+ "ID": "TR_6b6feea2",
1127
+ "parent": "CharacterisationProcedure",
1128
+ "child": "SamplePreparation"
1129
+ },
1130
+ {
1131
+ "ID": "TR_2b546462",
1132
+ "parent": "CharacterisationProcedure",
1133
+ "child": "SamplePreparation"
1134
+ },
1135
+ {
1136
+ "ID": "TR_c062bcee",
1137
+ "parent": "DCPolarography",
1138
+ "child": "SampledDCPolarography"
1139
+ },
1140
+ {
1141
+ "ID": "TR_ba19c415",
1142
+ "parent": "HydrodynamicVoltammetry",
1143
+ "child": "VoltammetryAtARotatingDiskElectrode"
1144
+ },
1145
+ {
1146
+ "ID": "TR_1cce87c5",
1147
+ "parent": "XrayDiffraction",
1148
+ "child": "XrayPowderDiffraction"
1149
+ }
1150
+ ]
1151
+ }
cifcore/cifcore.rst ADDED
@@ -0,0 +1,70 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Crystallographic Information Framework (CIF) Core Dictionary (CIFCore)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ (1) to explain the historical development of CIF dictionaries to define in a machine-actionable manner the contents
7
+ of data files covering various aspects of crystallography and related structural sciences; (2) to demonstrate
8
+ some of the more complex types of information that can be handled with this approach.
9
+
10
+ :Domain: Materials Science and Engineering
11
+ :Category: Materials Science
12
+ :Current Version: 0.1.0
13
+ :Last Updated: May 24, 2023
14
+ :Creator: None
15
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
16
+ :Format: TTL
17
+ :Download: `Crystallographic Information Framework (CIF) Core Dictionary (CIFCore) Homepage <https://github.com/emmo-repo/CIF-ontology?tab=readme-ov-file>`_
18
+
19
+ Graph Metrics
20
+ -------------
21
+ - **Total Nodes**: 4494
22
+ - **Total Edges**: 15377
23
+ - **Root Nodes**: 1
24
+ - **Leaf Nodes**: 3310
25
+
26
+ Knowledge coverage
27
+ ------------------
28
+ - Classes: 1182
29
+ - Individuals: 0
30
+ - Properties: 0
31
+
32
+ Hierarchical metrics
33
+ --------------------
34
+ - **Maximum Depth**: 1
35
+ - **Minimum Depth**: 0
36
+ - **Average Depth**: 0.75
37
+ - **Depth Variance**: 0.19
38
+
39
+ Breadth metrics
40
+ ------------------
41
+ - **Maximum Breadth**: 3
42
+ - **Minimum Breadth**: 1
43
+ - **Average Breadth**: 2.00
44
+ - **Breadth Variance**: 1.00
45
+
46
+ Dataset Statistics
47
+ ------------------
48
+ Generated Benchmarks:
49
+ - **Term Types**: 0
50
+ - **Taxonomic Relations**: 27150
51
+ - **Non-taxonomic Relations**: 0
52
+ - **Average Terms per Type**: 0.00
53
+
54
+ Usage Example
55
+ -------------
56
+ .. code-block:: python
57
+
58
+ from ontolearner.ontology import CIFCore
59
+
60
+ # Initialize and load ontology
61
+ ontology = CIFCore()
62
+ ontology.load("path/to/ontology.TTL")
63
+
64
+ # Extract datasets
65
+ data = ontology.extract()
66
+
67
+ # Access specific relations
68
+ term_types = data.term_typings
69
+ taxonomic_relations = data.type_taxonomies
70
+ non_taxonomic_relations = data.type_non_taxonomic_relations
cifcore/cifcore.ttl ADDED
The diff for this file is too large to render. See raw diff
 
cifcore/term_typings.json ADDED
@@ -0,0 +1 @@
 
 
1
+ []
cifcore/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,5 @@
 
 
 
 
 
 
1
+ {
2
+ "types": [],
3
+ "relations": [],
4
+ "non_taxonomies": []
5
+ }
cifcore/type_taxonomies.json ADDED
The diff for this file is too large to render. See raw diff
 
cmso/cmso.owl ADDED
@@ -0,0 +1,1478 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ <?xml version="1.0"?>
2
+ <rdf:RDF xmlns="http://purls.helmholtz-metadaten.de/cmso/"
3
+ xml:base="http://purls.helmholtz-metadaten.de/cmso/"
4
+ xmlns:dc="http://purl.org/dc/elements/1.1/"
5
+ xmlns:obo="http://purl.obolibrary.org/obo/"
6
+ xmlns:owl="http://www.w3.org/2002/07/owl#"
7
+ xmlns:rdf="http://www.w3.org/1999/02/22-rdf-syntax-ns#"
8
+ xmlns:xml="http://www.w3.org/XML/1998/namespace"
9
+ xmlns:xsd="http://www.w3.org/2001/XMLSchema#"
10
+ xmlns:rdfs="http://www.w3.org/2000/01/rdf-schema#"
11
+ xmlns:skos="http://www.w3.org/2004/02/skos/core#"
12
+ xmlns:terms="http://purl.org/dc/terms/"
13
+ xmlns:schema="https://schema.org/">
14
+ <owl:Ontology rdf:about="http://purls.helmholtz-metadaten.de/cmso/">
15
+ <terms:contributor rdf:resource="https://orcid.org/0000-0001-9560-4728"/>
16
+ <terms:contributor rdf:resource="https://orcid.org/0000-0002-5149-603X"/>
17
+ <terms:contributor rdf:resource="https://orcid.org/0000-0002-6776-1213"/>
18
+ <terms:contributor rdf:resource="https://orcid.org/0000-0003-0698-4891"/>
19
+ <terms:creator rdf:resource="https://orcid.org/0000-0001-7564-7990"/>
20
+ <terms:description>CMSO is an ontology that aims to describe computational materials science samples (or structures), including crystalline defects.</terms:description>
21
+ <terms:license rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://creativecommons.org/licenses/by/4.0/</terms:license>
22
+ <terms:title>Computational Material Sample Ontology (CMSO)</terms:title>
23
+ <rdfs:seeAlso rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://github.com/OCDO/cmso-ontology</rdfs:seeAlso>
24
+ <owl:versionInfo rdf:datatype="http://www.w3.org/2001/XMLSchema#string">0.0.1</owl:versionInfo>
25
+ <schema:citation rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Azocar Guzman, A., Menon, S., Hofmann, V., Hickel, T., Sandfeld. S. (2024), Computational Material Sample Ontology, https://purls.helmholtz-metadaten.de/cmso/</schema:citation>
26
+ <schema:creativeWorkStatus rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Ontology Specification</schema:creativeWorkStatus>
27
+ <schema:funder rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://ror.org/05qj6w324</schema:funder>
28
+ <schema:logo rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://raw.githubusercontent.com/OCDO/.github/refs/heads/main/profile/ocdo_logo.png</schema:logo>
29
+ </owl:Ontology>
30
+
31
+
32
+
33
+ <!--
34
+ ///////////////////////////////////////////////////////////////////////////////////////
35
+ //
36
+ // Annotation properties
37
+ //
38
+ ///////////////////////////////////////////////////////////////////////////////////////
39
+ -->
40
+
41
+
42
+
43
+
44
+ <!-- http://purl.obolibrary.org/obo/IAO_0000111 -->
45
+
46
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000111"/>
47
+
48
+
49
+
50
+ <!-- http://purl.obolibrary.org/obo/IAO_0000112 -->
51
+
52
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000112"/>
53
+
54
+
55
+
56
+ <!-- http://purl.obolibrary.org/obo/IAO_0000114 -->
57
+
58
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000114"/>
59
+
60
+
61
+
62
+ <!-- http://purl.obolibrary.org/obo/IAO_0000115 -->
63
+
64
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000115">
65
+ <obo:IAO_0000111 xml:lang="en">definition</obo:IAO_0000111>
66
+ <obo:IAO_0000114 rdf:resource="http://purl.obolibrary.org/obo/IAO_0000122"/>
67
+ <obo:IAO_0000115 xml:lang="en">The official definition, explaining the meaning of a class or property. Shall be Aristotelian, formalized and normalized. Can be augmented with colloquial definitions.</obo:IAO_0000115>
68
+ <obo:IAO_0000116 xml:lang="en">2012-04-05:
69
+ Barry Smith
70
+
71
+ The official OBI definition, explaining the meaning of a class or property: &apos;Shall be Aristotelian, formalized and normalized. Can be augmented with colloquial definitions&apos; is terrible.
72
+
73
+ Can you fix to something like:
74
+
75
+ A statement of necessary and sufficient conditions explaining the meaning of an expression referring to a class or property.
76
+
77
+ Alan Ruttenberg
78
+
79
+ Your proposed definition is a reasonable candidate, except that it is very common that necessary and sufficient conditions are not given. Mostly they are necessary, occasionally they are necessary and sufficient or just sufficient. Often they use terms that are not themselves defined and so they effectively can&apos;t be evaluated by those criteria.
80
+
81
+ On the specifics of the proposed definition:
82
+
83
+ We don&apos;t have definitions of &apos;meaning&apos; or &apos;expression&apos; or &apos;property&apos;. For &apos;reference&apos; in the intended sense I think we use the term &apos;denotation&apos;. For &apos;expression&apos;, I think we you mean symbol, or identifier. For &apos;meaning&apos; it differs for class and property. For class we want documentation that let&apos;s the intended reader determine whether an entity is instance of the class, or not. For property we want documentation that let&apos;s the intended reader determine, given a pair of potential relata, whether the assertion that the relation holds is true. The &apos;intended reader&apos; part suggests that we also specify who, we expect, would be able to understand the definition, and also generalizes over human and computer reader to include textual and logical definition.
84
+
85
+ Personally, I am more comfortable weakening definition to documentation, with instructions as to what is desirable.
86
+
87
+ We also have the outstanding issue of how to aim different definitions to different audiences. A clinical audience reading chebi wants a different sort of definition documentation/definition from a chemistry trained audience, and similarly there is a need for a definition that is adequate for an ontologist to work with.</obo:IAO_0000116>
88
+ <obo:IAO_0000117 xml:lang="en">PERSON:Daniel Schober</obo:IAO_0000117>
89
+ <obo:IAO_0000119 xml:lang="en">GROUP:OBI:&lt;http://purl.obolibrary.org/obo/obi&gt;</obo:IAO_0000119>
90
+ <rdfs:label xml:lang="en">definition</rdfs:label>
91
+ </owl:AnnotationProperty>
92
+
93
+
94
+
95
+ <!-- http://purl.obolibrary.org/obo/IAO_0000116 -->
96
+
97
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000116"/>
98
+
99
+
100
+
101
+ <!-- http://purl.obolibrary.org/obo/IAO_0000117 -->
102
+
103
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000117"/>
104
+
105
+
106
+
107
+ <!-- http://purl.obolibrary.org/obo/IAO_0000119 -->
108
+
109
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/IAO_0000119">
110
+ <obo:IAO_0000111 xml:lang="en">definition source</obo:IAO_0000111>
111
+ <obo:IAO_0000114 rdf:resource="http://purl.obolibrary.org/obo/IAO_0000122"/>
112
+ <obo:IAO_0000115 xml:lang="en">Formal citation, e.g. identifier in external database to indicate / attribute source(s) for the definition. Free text indicate / attribute source(s) for the definition. EXAMPLE: Author Name, URI, MeSH Term C04, PUBMED ID, Wiki uri on 31.01.2007</obo:IAO_0000115>
113
+ <obo:IAO_0000117 xml:lang="en">PERSON:Daniel Schober</obo:IAO_0000117>
114
+ <obo:IAO_0000119 xml:lang="en">Discussion on obo-discuss mailing-list, see http://bit.ly/hgm99w</obo:IAO_0000119>
115
+ <obo:IAO_0000119 xml:lang="en">GROUP:OBI:&lt;http://purl.obolibrary.org/obo/obi&gt;</obo:IAO_0000119>
116
+ <rdfs:label xml:lang="en">definition source</rdfs:label>
117
+ </owl:AnnotationProperty>
118
+
119
+
120
+
121
+ <!-- http://purl.obolibrary.org/obo/OBCS_0000221 -->
122
+
123
+ <owl:AnnotationProperty rdf:about="http://purl.obolibrary.org/obo/OBCS_0000221">
124
+ <obo:IAO_0000112>A normal distribution probability density function has a formula of:
125
+ f(x) = 1/(√(2 π) σ) e^-((x - μ)^2/(2 σ^2))</obo:IAO_0000112>
126
+ <obo:IAO_0000115>An annotation property that represents a mathematical formula.</obo:IAO_0000115>
127
+ <obo:IAO_0000117>Asiyah Yu Lin, Jie Zheng, Yongqun He</obo:IAO_0000117>
128
+ <rdfs:label xml:lang="en">mathematical formula</rdfs:label>
129
+ </owl:AnnotationProperty>
130
+
131
+
132
+
133
+ <!-- http://purl.org/dc/elements/1.1/contributor -->
134
+
135
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/contributor"/>
136
+
137
+
138
+
139
+ <!-- http://purl.org/dc/elements/1.1/creator -->
140
+
141
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/creator"/>
142
+
143
+
144
+
145
+ <!-- http://purl.org/dc/elements/1.1/description -->
146
+
147
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/description"/>
148
+
149
+
150
+
151
+ <!-- http://purl.org/dc/elements/1.1/title -->
152
+
153
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/elements/1.1/title"/>
154
+
155
+
156
+
157
+ <!-- http://purl.org/dc/terms/abstract -->
158
+
159
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/abstract">
160
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/terms/description"/>
161
+ </owl:AnnotationProperty>
162
+
163
+
164
+
165
+ <!-- http://purl.org/dc/terms/alternative -->
166
+
167
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/alternative">
168
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/terms/title"/>
169
+ </owl:AnnotationProperty>
170
+
171
+
172
+
173
+ <!-- http://purl.org/dc/terms/contributor -->
174
+
175
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/contributor">
176
+ <rdfs:comment xml:lang="en-us">Examples of a Contributor include a person, an organization, or a service. Typically, the name of a Contributor should be used to indicate the entity.</rdfs:comment>
177
+ <rdfs:label xml:lang="en-us">Contributor</rdfs:label>
178
+ <skos:definition xml:lang="en-us">An entity responsible for making contributions to the resource.</skos:definition>
179
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/contributor"/>
180
+ </owl:AnnotationProperty>
181
+
182
+
183
+
184
+ <!-- http://purl.org/dc/terms/creator -->
185
+
186
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/creator">
187
+ <rdfs:comment xml:lang="en-us">Examples of a Creator include a person, an organization, or a service. Typically, the name of a Creator should be used to indicate the entity.</rdfs:comment>
188
+ <rdfs:label xml:lang="en-us">Creator</rdfs:label>
189
+ <skos:definition xml:lang="en-us">An entity primarily responsible for making the resource.</skos:definition>
190
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/creator"/>
191
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/terms/contributor"/>
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+ <rdfs:range rdf:resource="http://purl.org/dc/terms/Agent"/>
193
+ </owl:AnnotationProperty>
194
+
195
+
196
+
197
+ <!-- http://purl.org/dc/terms/description -->
198
+
199
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/description">
200
+ <rdfs:comment xml:lang="en-us">Description may include but is not limited to: an abstract, a table of contents, a graphical representation, or a free-text account of the resource.</rdfs:comment>
201
+ <rdfs:label xml:lang="en-us">Description</rdfs:label>
202
+ <skos:definition xml:lang="en-us">An account of the resource.</skos:definition>
203
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/description"/>
204
+ </owl:AnnotationProperty>
205
+
206
+
207
+
208
+ <!-- http://purl.org/dc/terms/license -->
209
+
210
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/license">
211
+ <rdfs:label xml:lang="en-us">License</rdfs:label>
212
+ <skos:definition xml:lang="en-us">A legal document giving official permission to do something with the resource.</skos:definition>
213
+ <rdfs:range rdf:resource="http://purl.org/dc/terms/LicenseDocument"/>
214
+ </owl:AnnotationProperty>
215
+
216
+
217
+
218
+ <!-- http://purl.org/dc/terms/tableOfContents -->
219
+
220
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/tableOfContents">
221
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/terms/description"/>
222
+ </owl:AnnotationProperty>
223
+
224
+
225
+
226
+ <!-- http://purl.org/dc/terms/title -->
227
+
228
+ <owl:AnnotationProperty rdf:about="http://purl.org/dc/terms/title">
229
+ <rdfs:label xml:lang="en-us">Title</rdfs:label>
230
+ <skos:definition xml:lang="en-us">A name given to the resource.</skos:definition>
231
+ <skos:note xml:lang="en-us">In current practice, this term is used primarily with literal values; however, there are important uses with non-literal values as well. As of December 2007, the DCMI Usage Board is leaving this range unspecified pending an investigation of options.</skos:note>
232
+ <rdfs:subPropertyOf rdf:resource="http://purl.org/dc/elements/1.1/title"/>
233
+ </owl:AnnotationProperty>
234
+
235
+
236
+
237
+ <!-- http://www.w3.org/2004/02/skos/core#altLabel -->
238
+
239
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#altLabel">
240
+ <rdfs:comment xml:lang="en">The range of skos:altLabel is the class of RDF plain literals.</rdfs:comment>
241
+ <rdfs:comment xml:lang="en">skos:prefLabel, skos:altLabel and skos:hiddenLabel are pairwise disjoint properties.</rdfs:comment>
242
+ <rdfs:isDefinedBy rdf:resource="http://www.w3.org/2004/02/skos/core"/>
243
+ <rdfs:label xml:lang="en">alternative label</rdfs:label>
244
+ <skos:definition xml:lang="en">An alternative lexical label for a resource.</skos:definition>
245
+ <skos:example xml:lang="en">Acronyms, abbreviations, spelling variants, and irregular plural/singular forms may be included among the alternative labels for a concept. Mis-spelled terms are normally included as hidden labels (see skos:hiddenLabel).</skos:example>
246
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2000/01/rdf-schema#label"/>
247
+ </owl:AnnotationProperty>
248
+
249
+
250
+
251
+ <!-- http://www.w3.org/2004/02/skos/core#definition -->
252
+
253
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#definition">
254
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2004/02/skos/core#note"/>
255
+ </owl:AnnotationProperty>
256
+
257
+
258
+
259
+ <!-- http://www.w3.org/2004/02/skos/core#example -->
260
+
261
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#example">
262
+ <rdfs:isDefinedBy rdf:resource="http://www.w3.org/2004/02/skos/core"/>
263
+ <rdfs:label xml:lang="en">example</rdfs:label>
264
+ <skos:definition xml:lang="en">An example of the use of a concept.</skos:definition>
265
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2004/02/skos/core#note"/>
266
+ </owl:AnnotationProperty>
267
+
268
+
269
+
270
+ <!-- http://www.w3.org/2004/02/skos/core#note -->
271
+
272
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#note">
273
+ <skos:definition xml:lang="en">A general note, for any purpose.</skos:definition>
274
+ </owl:AnnotationProperty>
275
+
276
+
277
+
278
+ <!-- http://www.w3.org/2004/02/skos/core#prefLabel -->
279
+
280
+ <owl:AnnotationProperty rdf:about="http://www.w3.org/2004/02/skos/core#prefLabel">
281
+ <rdfs:comment xml:lang="en">A resource has no more than one value of skos:prefLabel per language tag, and no more than one value of skos:prefLabel without language tag.</rdfs:comment>
282
+ <rdfs:comment xml:lang="en">The range of skos:prefLabel is the class of RDF plain literals.</rdfs:comment>
283
+ <rdfs:comment xml:lang="en">skos:prefLabel, skos:altLabel and skos:hiddenLabel are pairwise
284
+ disjoint properties.</rdfs:comment>
285
+ <rdfs:isDefinedBy rdf:resource="http://www.w3.org/2004/02/skos/core"/>
286
+ <rdfs:label xml:lang="en">preferred label</rdfs:label>
287
+ <skos:definition xml:lang="en">The preferred lexical label for a resource, in a given language.</skos:definition>
288
+ <rdfs:subPropertyOf rdf:resource="http://www.w3.org/2000/01/rdf-schema#label"/>
289
+ </owl:AnnotationProperty>
290
+
291
+
292
+
293
+ <!-- https://schema.org/citation -->
294
+
295
+ <owl:AnnotationProperty rdf:about="https://schema.org/citation"/>
296
+
297
+
298
+
299
+ <!-- https://schema.org/creativeWorkStatus -->
300
+
301
+ <owl:AnnotationProperty rdf:about="https://schema.org/creativeWorkStatus"/>
302
+
303
+
304
+
305
+ <!-- https://schema.org/funder -->
306
+
307
+ <owl:AnnotationProperty rdf:about="https://schema.org/funder"/>
308
+
309
+
310
+
311
+ <!-- https://schema.org/logo -->
312
+
313
+ <owl:AnnotationProperty rdf:about="https://schema.org/logo"/>
314
+
315
+
316
+
317
+ <!--
318
+ ///////////////////////////////////////////////////////////////////////////////////////
319
+ //
320
+ // Datatypes
321
+ //
322
+ ///////////////////////////////////////////////////////////////////////////////////////
323
+ -->
324
+
325
+
326
+
327
+
328
+ <!-- http://qudt.org/schema/qudt/LatexString -->
329
+
330
+ <rdfs:Datatype rdf:about="http://qudt.org/schema/qudt/LatexString"/>
331
+
332
+
333
+
334
+ <!--
335
+ ///////////////////////////////////////////////////////////////////////////////////////
336
+ //
337
+ // Object Properties
338
+ //
339
+ ///////////////////////////////////////////////////////////////////////////////////////
340
+ -->
341
+
342
+
343
+
344
+
345
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/hasCrystallographicDefect -->
346
+
347
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/hasCrystallographicDefect">
348
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallineMaterial"/>
349
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect"/>
350
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a crystalline material and a crystallographic defect, such as vacancies, interstitials, or dislocations.</obo:IAO_0000115>
351
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has crystallographic defect</rdfs:label>
352
+ </owl:ObjectProperty>
353
+
354
+
355
+
356
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasAngle -->
357
+
358
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasAngle">
359
+ <rdfs:domain>
360
+ <owl:Class>
361
+ <owl:unionOf rdf:parseType="Collection">
362
+ <rdf:Description rdf:about="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
363
+ <rdf:Description rdf:about="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
364
+ </owl:unionOf>
365
+ </owl:Class>
366
+ </rdfs:domain>
367
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Angle"/>
368
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a simulation or unit cell and its angle.</obo:IAO_0000115>
369
+ <rdfs:label>has angle</rdfs:label>
370
+ </owl:ObjectProperty>
371
+
372
+
373
+
374
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasAttribute -->
375
+
376
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasAttribute">
377
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomicScaleSample"/>
378
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute"/>
379
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a sample and a type of atom attribute, which refers to a per atom quantity of the atomic scale sample.</obo:IAO_0000115>
380
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has attribute</rdfs:label>
381
+ </owl:ObjectProperty>
382
+
383
+
384
+
385
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasBasis -->
386
+
387
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasBasis">
388
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
389
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Basis"/>
390
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a unit cell and the basis of the crystal structure.</obo:IAO_0000115>
391
+ <rdfs:label>has basis</rdfs:label>
392
+ </owl:ObjectProperty>
393
+
394
+
395
+
396
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasElement -->
397
+
398
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasElement">
399
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalSpecies"/>
400
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalElement"/>
401
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between an atom and its chemical element.</obo:IAO_0000115>
402
+ <rdfs:label>has element</rdfs:label>
403
+ </owl:ObjectProperty>
404
+
405
+
406
+
407
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasLatticeParameter -->
408
+
409
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasLatticeParameter">
410
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
411
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/LatticeParameter"/>
412
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a unit cell and its lattice parameters.</obo:IAO_0000115>
413
+ <rdfs:label>has lattice parameter</rdfs:label>
414
+ </owl:ObjectProperty>
415
+
416
+
417
+
418
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasLength -->
419
+
420
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasLength">
421
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
422
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCellLength"/>
423
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a simulation cell and its length.</obo:IAO_0000115>
424
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has simulation cell length</rdfs:label>
425
+ </owl:ObjectProperty>
426
+
427
+
428
+
429
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasMaterial -->
430
+
431
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasMaterial">
432
+ <owl:inverseOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/isMaterialOf"/>
433
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample"/>
434
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/Material"/>
435
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a computational sample and the material it represents.</obo:IAO_0000115>
436
+ <rdfs:label>has material</rdfs:label>
437
+ </owl:ObjectProperty>
438
+
439
+
440
+
441
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasNormalVector -->
442
+
443
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasNormalVector">
444
+ <rdfs:subPropertyOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/hasVector"/>
445
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Plane"/>
446
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/NormalVector"/>
447
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a plane and a vector normal to it.</obo:IAO_0000115>
448
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has normal vector</rdfs:label>
449
+ </owl:ObjectProperty>
450
+
451
+
452
+
453
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasSimulationCell -->
454
+
455
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasSimulationCell">
456
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomicScaleSample"/>
457
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
458
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between an atomic scale sample and the simulation cell.</obo:IAO_0000115>
459
+ <rdfs:label>has simulation cell</rdfs:label>
460
+ </owl:ObjectProperty>
461
+
462
+
463
+
464
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasSimulationCellVolume -->
465
+
466
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasSimulationCellVolume">
467
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
468
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCellVolume"/>
469
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a simulation cell and its volume.</obo:IAO_0000115>
470
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has simulation cell volume</rdfs:label>
471
+ </owl:ObjectProperty>
472
+
473
+
474
+
475
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasSpaceGroup -->
476
+
477
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasSpaceGroup">
478
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/CrystalStructure"/>
479
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SpaceGroup"/>
480
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a crystal structure and the space group that describes the symmetry.</obo:IAO_0000115>
481
+ <rdfs:label>has space group</rdfs:label>
482
+ </owl:ObjectProperty>
483
+
484
+
485
+
486
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasSpecies -->
487
+
488
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasSpecies">
489
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample"/>
490
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalSpecies"/>
491
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a computational sample and the species that constitutes it.</obo:IAO_0000115>
492
+ <rdfs:label>has species</rdfs:label>
493
+ </owl:ObjectProperty>
494
+
495
+
496
+
497
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasStructure -->
498
+
499
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasStructure">
500
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/Material"/>
501
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Structure"/>
502
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a material and its structure.</obo:IAO_0000115>
503
+ <rdfs:label>has structure</rdfs:label>
504
+ </owl:ObjectProperty>
505
+
506
+
507
+
508
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasUnit -->
509
+
510
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasUnit">
511
+ <rdfs:domain rdf:resource="http://www.w3.org/2002/07/owl#Thing"/>
512
+ <rdfs:range rdf:resource="http://qudt.org/schema/qudt/Unit"/>
513
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A relation indicating the unit.</obo:IAO_0000115>
514
+ <rdfs:label>has unit</rdfs:label>
515
+ </owl:ObjectProperty>
516
+
517
+
518
+
519
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasUnitCell -->
520
+
521
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasUnitCell">
522
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/CrystalStructure"/>
523
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
524
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between a crystal structure and its unit cell.</obo:IAO_0000115>
525
+ <rdfs:label>has unit cell</rdfs:label>
526
+ </owl:ObjectProperty>
527
+
528
+
529
+
530
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasVector -->
531
+
532
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasVector">
533
+ <rdfs:domain>
534
+ <owl:Class>
535
+ <owl:unionOf rdf:parseType="Collection">
536
+ <rdf:Description rdf:about="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
537
+ <rdf:Description rdf:about="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
538
+ </owl:unionOf>
539
+ </owl:Class>
540
+ </rdfs:domain>
541
+ <rdfs:range rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Vector"/>
542
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The relation between an entity and its vectors.</obo:IAO_0000115>
543
+ <rdfs:label>has vector</rdfs:label>
544
+ </owl:ObjectProperty>
545
+
546
+
547
+
548
+ <!-- http://purls.helmholtz-metadaten.de/cmso/isCalculatedPropertyOf -->
549
+
550
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/isCalculatedPropertyOf">
551
+ <rdfs:label>is calculated property of</rdfs:label>
552
+ </owl:ObjectProperty>
553
+
554
+
555
+
556
+ <!-- http://purls.helmholtz-metadaten.de/cmso/isDefectOf -->
557
+
558
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/isDefectOf">
559
+ <rdfs:label>is defect of</rdfs:label>
560
+ </owl:ObjectProperty>
561
+
562
+
563
+
564
+ <!-- http://purls.helmholtz-metadaten.de/cmso/isMaterialOf -->
565
+
566
+ <owl:ObjectProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/isMaterialOf">
567
+ <rdfs:label>is material of</rdfs:label>
568
+ </owl:ObjectProperty>
569
+
570
+
571
+
572
+ <!--
573
+ ///////////////////////////////////////////////////////////////////////////////////////
574
+ //
575
+ // Data properties
576
+ //
577
+ ///////////////////////////////////////////////////////////////////////////////////////
578
+ -->
579
+
580
+
581
+
582
+
583
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasAltName -->
584
+
585
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasAltName">
586
+ <rdfs:subPropertyOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/hasName"/>
587
+ <rdfs:domain rdf:resource="http://www.w3.org/2002/07/owl#Thing"/>
588
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
589
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an entity with alternative names.</obo:IAO_0000115>
590
+ <rdfs:label>has alternative name</rdfs:label>
591
+ </owl:DatatypeProperty>
592
+
593
+
594
+
595
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasAngle_alpha -->
596
+
597
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasAngle_alpha">
598
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Angle"/>
599
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
600
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking the angle to the measurement in the x axis.</obo:IAO_0000115>
601
+ <rdfs:label>has angle alpha</rdfs:label>
602
+ </owl:DatatypeProperty>
603
+
604
+
605
+
606
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasAngle_beta -->
607
+
608
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasAngle_beta">
609
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Angle"/>
610
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
611
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking the angle to the measurement in the y axis.</obo:IAO_0000115>
612
+ <rdfs:label>has angle beta</rdfs:label>
613
+ </owl:DatatypeProperty>
614
+
615
+
616
+
617
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasAngle_gamma -->
618
+
619
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasAngle_gamma">
620
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Angle"/>
621
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
622
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking the angle to the measurement in the z axis.</obo:IAO_0000115>
623
+ <rdfs:label>has angle gamma</rdfs:label>
624
+ </owl:DatatypeProperty>
625
+
626
+
627
+
628
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasAtomicPercent -->
629
+
630
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasAtomicPercent">
631
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalElement"/>
632
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
633
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a chemical element with atomic percentage present in the material.</obo:IAO_0000115>
634
+ <rdfs:comment>abbreviated at.%</rdfs:comment>
635
+ <rdfs:label>has atomic percent</rdfs:label>
636
+ </owl:DatatypeProperty>
637
+
638
+
639
+
640
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasBravaisLattice -->
641
+
642
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasBravaisLattice">
643
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
644
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
645
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking the crystal structure and the corresponding Bravais lattice.</obo:IAO_0000115>
646
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has Bravais lattice</rdfs:label>
647
+ </owl:DatatypeProperty>
648
+
649
+
650
+
651
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasChemicalSymbol -->
652
+
653
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasChemicalSymbol">
654
+ <rdfs:subPropertyOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/hasSymbol"/>
655
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalElement"/>
656
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
657
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an element with its chemical symbol.</obo:IAO_0000115>
658
+ <rdfs:label>has chemical symbol</rdfs:label>
659
+ </owl:DatatypeProperty>
660
+
661
+
662
+
663
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasComponent_x -->
664
+
665
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasComponent_x">
666
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Vector"/>
667
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
668
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a vector with its component on the x axis.</obo:IAO_0000115>
669
+ <rdfs:label>has component x</rdfs:label>
670
+ </owl:DatatypeProperty>
671
+
672
+
673
+
674
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasComponent_y -->
675
+
676
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasComponent_y">
677
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Vector"/>
678
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
679
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a vector with its component on the y axis.</obo:IAO_0000115>
680
+ <rdfs:label>has component y</rdfs:label>
681
+ </owl:DatatypeProperty>
682
+
683
+
684
+
685
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasComponent_z -->
686
+
687
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasComponent_z">
688
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Vector"/>
689
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
690
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a vector with its component on the z axis.</obo:IAO_0000115>
691
+ <rdfs:label>has component z</rdfs:label>
692
+ </owl:DatatypeProperty>
693
+
694
+
695
+
696
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasDistanceFromOrigin -->
697
+
698
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasDistanceFromOrigin">
699
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Plane"/>
700
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
701
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an plane with the value of distance from its origin.</obo:IAO_0000115>
702
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has distance from origin</rdfs:label>
703
+ </owl:DatatypeProperty>
704
+
705
+
706
+
707
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasElementRatio -->
708
+
709
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasElementRatio">
710
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalElement"/>
711
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
712
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a chemical element with the ratio or fraction of it in the material.</obo:IAO_0000115>
713
+ <rdfs:comment>Indicated with a value from 0 to 1.</rdfs:comment>
714
+ <rdfs:label>has element ratio</rdfs:label>
715
+ </owl:DatatypeProperty>
716
+
717
+
718
+
719
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasIdentifier -->
720
+
721
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasIdentifier">
722
+ <rdfs:domain rdf:resource="http://www.w3.org/2002/07/owl#Thing"/>
723
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
724
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an entity with an identifier (internal or external) that represents the entity.</obo:IAO_0000115>
725
+ <rdfs:label>has identifier</rdfs:label>
726
+ </owl:DatatypeProperty>
727
+
728
+
729
+
730
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasLength_x -->
731
+
732
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasLength_x">
733
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCellLength"/>
734
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
735
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
736
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a length to the measurement in the x axis.</obo:IAO_0000115>
737
+ <rdfs:label>has length x</rdfs:label>
738
+ </owl:DatatypeProperty>
739
+
740
+
741
+
742
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasLength_y -->
743
+
744
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasLength_y">
745
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCellLength"/>
746
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
747
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
748
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a length to the measurement in the y axis.</obo:IAO_0000115>
749
+ <rdfs:label>has length y</rdfs:label>
750
+ </owl:DatatypeProperty>
751
+
752
+
753
+
754
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasLength_z -->
755
+
756
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasLength_z">
757
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCellLength"/>
758
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/UnitCell"/>
759
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
760
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a length to the measurement in the z axis.</obo:IAO_0000115>
761
+ <rdfs:label>has length z</rdfs:label>
762
+ </owl:DatatypeProperty>
763
+
764
+
765
+
766
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasName -->
767
+
768
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasName">
769
+ <rdfs:domain rdf:resource="http://www.w3.org/2002/07/owl#Thing"/>
770
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
771
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an entity with its name.</obo:IAO_0000115>
772
+ <rdfs:label>has name</rdfs:label>
773
+ </owl:DatatypeProperty>
774
+
775
+
776
+
777
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasNumberOfAtoms -->
778
+
779
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasNumberOfAtoms">
780
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomicScaleSample"/>
781
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#integer"/>
782
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an atomic scale sample with the number of atoms it contains.</obo:IAO_0000115>
783
+ <rdfs:label>has number of atoms</rdfs:label>
784
+ </owl:DatatypeProperty>
785
+
786
+
787
+
788
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasPath -->
789
+
790
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasPath">
791
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute"/>
792
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
793
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an atom attribute (per atom quantity) with the path pointing to the file where the data is stored.</obo:IAO_0000115>
794
+ <rdfs:label>has path</rdfs:label>
795
+ </owl:DatatypeProperty>
796
+
797
+
798
+
799
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasReference -->
800
+
801
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasReference">
802
+ <rdfs:domain rdf:resource="http://www.w3.org/2002/07/owl#Thing"/>
803
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#anyURI"/>
804
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an entity with a reference (e.g. bibliographic) to another resource.</obo:IAO_0000115>
805
+ <rdfs:comment rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The expected usage is to provide a Uniform Resource Identifier Reference (URI), which should point the referenced resource (e.g. a DOI for a publication)</rdfs:comment>
806
+ <rdfs:label>has reference</rdfs:label>
807
+ </owl:DatatypeProperty>
808
+
809
+
810
+
811
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasRepetition_x -->
812
+
813
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasRepetition_x">
814
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
815
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#integer"/>
816
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a simulation cell with its number of repetitions in the x direction.</obo:IAO_0000115>
817
+ <rdfs:label>has repetition x</rdfs:label>
818
+ </owl:DatatypeProperty>
819
+
820
+
821
+
822
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasRepetition_y -->
823
+
824
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasRepetition_y">
825
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
826
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#integer"/>
827
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a simulation cell with its number of repetitions in the y direction.</obo:IAO_0000115>
828
+ <rdfs:label>has repetition y</rdfs:label>
829
+ </owl:DatatypeProperty>
830
+
831
+
832
+
833
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasRepetition_z -->
834
+
835
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasRepetition_z">
836
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
837
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#integer"/>
838
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a simulation cell with its number of repetitions in the z direction.</obo:IAO_0000115>
839
+ <rdfs:label>has repetition z</rdfs:label>
840
+ </owl:DatatypeProperty>
841
+
842
+
843
+
844
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasSpaceGroupNumber -->
845
+
846
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasSpaceGroupNumber">
847
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/CrystalStructure"/>
848
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#integer"/>
849
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a crystal structure with its space group number.</obo:IAO_0000115>
850
+ <rdfs:label>has space group number</rdfs:label>
851
+ </owl:DatatypeProperty>
852
+
853
+
854
+
855
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasSpaceGroupSymbol -->
856
+
857
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasSpaceGroupSymbol">
858
+ <rdfs:subPropertyOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/hasSymbol"/>
859
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/CrystalStructure"/>
860
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
861
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a crystal structure with its space group symbol.</obo:IAO_0000115>
862
+ <rdfs:label>has space group symbol</rdfs:label>
863
+ </owl:DatatypeProperty>
864
+
865
+
866
+
867
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasSymbol -->
868
+
869
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasSymbol">
870
+ <rdfs:domain rdf:resource="http://www.w3.org/2002/07/owl#Thing"/>
871
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
872
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an entity with its symbol.</obo:IAO_0000115>
873
+ <rdfs:label>has symbol</rdfs:label>
874
+ </owl:DatatypeProperty>
875
+
876
+
877
+
878
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasVacuumDirection -->
879
+
880
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasVacuumDirection">
881
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
882
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#string"/>
883
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property defining the parameter that indicates the specific direction(s) in which vacuum space is added in a simulation cell</obo:IAO_0000115>
884
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has vacuum direction</rdfs:label>
885
+ </owl:DatatypeProperty>
886
+
887
+
888
+
889
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasVacuumLength -->
890
+
891
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasVacuumLength">
892
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
893
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
894
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property defining the distance or thickness of vacuum space included in a simulation cell, often used to separate periodic images of a system to prevent interactions between them, especially in slab or surface simulations.</obo:IAO_0000115>
895
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">has vacuum length</rdfs:label>
896
+ </owl:DatatypeProperty>
897
+
898
+
899
+
900
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasValue -->
901
+
902
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasValue">
903
+ <rdfs:domain rdf:resource="http://www.w3.org/2002/07/owl#Thing"/>
904
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
905
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking an entity to its value.</obo:IAO_0000115>
906
+ <rdfs:label>has value</rdfs:label>
907
+ </owl:DatatypeProperty>
908
+
909
+
910
+
911
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasVolume -->
912
+
913
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasVolume">
914
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/SimulationCell"/>
915
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
916
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a simulation cell with its volume. Comment: the unit of the volume is indicated by the unit of the simulation cell length.</obo:IAO_0000115>
917
+ <rdfs:label>has volume</rdfs:label>
918
+ </owl:DatatypeProperty>
919
+
920
+
921
+
922
+ <!-- http://purls.helmholtz-metadaten.de/cmso/hasWeightPercent -->
923
+
924
+ <owl:DatatypeProperty rdf:about="http://purls.helmholtz-metadaten.de/cmso/hasWeightPercent">
925
+ <rdfs:domain rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalElement"/>
926
+ <rdfs:range rdf:resource="http://www.w3.org/2001/XMLSchema#float"/>
927
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A data property linking a chemical element with percentage by mass present in the material.</obo:IAO_0000115>
928
+ <rdfs:comment>abbreviated wt.%</rdfs:comment>
929
+ <rdfs:label>has weight percent</rdfs:label>
930
+ </owl:DatatypeProperty>
931
+
932
+
933
+
934
+ <!--
935
+ ///////////////////////////////////////////////////////////////////////////////////////
936
+ //
937
+ // Classes
938
+ //
939
+ ///////////////////////////////////////////////////////////////////////////////////////
940
+ -->
941
+
942
+
943
+
944
+
945
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallineMaterial -->
946
+
947
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallineMaterial">
948
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/Material"/>
949
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Crystalline material is material characterized by a periodic arrangement of the constituent atoms. The arrangement could be described its crystal structure.</obo:IAO_0000115>
950
+ <rdfs:label>Crystalline Material</rdfs:label>
951
+ </owl:Class>
952
+
953
+
954
+
955
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect -->
956
+
957
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/CrystallographicDefect">
958
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Lattice irregularity having one or more of its dimensions on the order of an atomic diameter.</obo:IAO_0000115>
959
+ <rdfs:label>Crystallographic Defect</rdfs:label>
960
+ </owl:Class>
961
+
962
+
963
+
964
+ <!-- http://purls.helmholtz-metadaten.de/cdos/cdco/Material -->
965
+
966
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cdos/cdco/Material">
967
+ <owl:equivalentClass rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Material"/>
968
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Materials are substances in the condensed states (liquid, solid, colloidal) designed or manipulated for technological ends.</obo:IAO_0000115>
969
+ <obo:IAO_0000119 rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://web.archive.org/web/20100801234616/http://www.nature.com/nmat/authors/index.html</obo:IAO_0000119>
970
+ <rdfs:label>Material</rdfs:label>
971
+ </owl:Class>
972
+
973
+
974
+
975
+ <!-- http://purls.helmholtz-metadaten.de/cmso/AmorphousMaterial -->
976
+
977
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/AmorphousMaterial">
978
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cdos/cdco/Material"/>
979
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">An amorphous material or solid is a material which has no defined long-range order.</obo:IAO_0000115>
980
+ <rdfs:label>Amorphous Material</rdfs:label>
981
+ <skos:altLabel>Amorphous Solid</skos:altLabel>
982
+ <skos:altLabel>Non-crystalline Solid</skos:altLabel>
983
+ </owl:Class>
984
+
985
+
986
+
987
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Angle -->
988
+
989
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Angle">
990
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">An angle is a measure of the the space (usually in degrees) between two intersecting lines at the point where they meet or vertex.</obo:IAO_0000115>
991
+ <rdfs:label>Angle</rdfs:label>
992
+ </owl:Class>
993
+
994
+
995
+
996
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Atom -->
997
+
998
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Atom">
999
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalSpecies"/>
1000
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Smallest particle still characterizing a chemical element. It consists of a nucleus of a positive charge (Z is the proton number and e the elementary charge) carrying almost all its mass (more than 99.9%) and Z electrons determining its size.</obo:IAO_0000115>
1001
+ <obo:IAO_0000119 rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://goldbook.iupac.org/terms/view/A00493</obo:IAO_0000119>
1002
+ <rdfs:label>Atom</rdfs:label>
1003
+ </owl:Class>
1004
+
1005
+
1006
+
1007
+ <!-- http://purls.helmholtz-metadaten.de/cmso/AtomAttribute -->
1008
+
1009
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute">
1010
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Atom attribute refers to the features or quantities per atom of an atomic scale sample.</obo:IAO_0000115>
1011
+ <rdfs:label>Atom Attribute</rdfs:label>
1012
+ </owl:Class>
1013
+
1014
+
1015
+
1016
+ <!-- http://purls.helmholtz-metadaten.de/cmso/AtomicForce -->
1017
+
1018
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/AtomicForce">
1019
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute"/>
1020
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Atomic force refers to the vector that represents the force of each atom.</obo:IAO_0000115>
1021
+ <rdfs:label>Atomic Force</rdfs:label>
1022
+ </owl:Class>
1023
+
1024
+
1025
+
1026
+ <!-- http://purls.helmholtz-metadaten.de/cmso/AtomicPosition -->
1027
+
1028
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/AtomicPosition">
1029
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute"/>
1030
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Atomic position refers to the vector that represents the position of each atom.</obo:IAO_0000115>
1031
+ <rdfs:comment>Cartesian coordinates are preferred over direct (or fractional) coordinates.</rdfs:comment>
1032
+ <rdfs:label>Atomic Position</rdfs:label>
1033
+ </owl:Class>
1034
+
1035
+
1036
+
1037
+ <!-- http://purls.helmholtz-metadaten.de/cmso/AtomicScaleSample -->
1038
+
1039
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/AtomicScaleSample">
1040
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample"/>
1041
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Atomic scale sample is a computational sample in the atomic length scale.</obo:IAO_0000115>
1042
+ <rdfs:label>Atomic Scale Sample</rdfs:label>
1043
+ </owl:Class>
1044
+
1045
+
1046
+
1047
+ <!-- http://purls.helmholtz-metadaten.de/cmso/AtomicVelocity -->
1048
+
1049
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/AtomicVelocity">
1050
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute"/>
1051
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Atomic velocity refers to the vector that represents the velocity of each atom.</obo:IAO_0000115>
1052
+ <rdfs:label>Atomic Velocity</rdfs:label>
1053
+ </owl:Class>
1054
+
1055
+
1056
+
1057
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Basis -->
1058
+
1059
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Basis">
1060
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The basis of a crystal indicates the arrangement or position of atoms in the crystal lattice.</obo:IAO_0000115>
1061
+ <rdfs:label>Basis</rdfs:label>
1062
+ </owl:Class>
1063
+
1064
+
1065
+
1066
+ <!-- http://purls.helmholtz-metadaten.de/cmso/ChemicalComposition -->
1067
+
1068
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/ChemicalComposition">
1069
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Chemical composition refers to the type, arrangement and ratio of the chemical elements of a compound (or material).</obo:IAO_0000115>
1070
+ <rdfs:label>Chemical Composition</rdfs:label>
1071
+ </owl:Class>
1072
+
1073
+
1074
+
1075
+ <!-- http://purls.helmholtz-metadaten.de/cmso/ChemicalElement -->
1076
+
1077
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/ChemicalElement">
1078
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A species of atoms; all atoms with the same number of protons in the atomic nucleus.</obo:IAO_0000115>
1079
+ <obo:IAO_0000119 rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://goldbook.iupac.org/terms/view/C01022</obo:IAO_0000119>
1080
+ <rdfs:label>Chemical Element</rdfs:label>
1081
+ </owl:Class>
1082
+
1083
+
1084
+
1085
+ <!-- http://purls.helmholtz-metadaten.de/cmso/ChemicalSpecies -->
1086
+
1087
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/ChemicalSpecies">
1088
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A chemical species is an ensemble of chemically identical atomic or molecular structural units in a solid array. Comment: In this context, it refers to either an atom, ion or molecule.</obo:IAO_0000115>
1089
+ <obo:IAO_0000119 rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://goldbook.iupac.org/terms/view/CT01038</obo:IAO_0000119>
1090
+ <rdfs:comment>In this context, it refers to either an atom, ion or molecule.</rdfs:comment>
1091
+ <rdfs:label>Chemical Species</rdfs:label>
1092
+ </owl:Class>
1093
+
1094
+
1095
+
1096
+ <!-- http://purls.helmholtz-metadaten.de/cmso/ComputationalSample -->
1097
+
1098
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample">
1099
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A computational sample is a representative system of a material for analysis through computational methods in the context of materials science.</obo:IAO_0000115>
1100
+ <rdfs:label>Computational Sample</rdfs:label>
1101
+ </owl:Class>
1102
+
1103
+
1104
+
1105
+ <!-- http://purls.helmholtz-metadaten.de/cmso/CoordinationNumber -->
1106
+
1107
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/CoordinationNumber">
1108
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute"/>
1109
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Coordination number refers to the number of neighbors of each atom.</obo:IAO_0000115>
1110
+ <rdfs:comment>In the case of molecules, it refers to the number of atoms, molecules or ions bonded to a central atom of the molecule. Also known as ligancy.</rdfs:comment>
1111
+ <rdfs:label>Coordination Number</rdfs:label>
1112
+ </owl:Class>
1113
+
1114
+
1115
+
1116
+ <!-- http://purls.helmholtz-metadaten.de/cmso/CrystalDefect -->
1117
+
1118
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/CrystalDefect">
1119
+ <obo:IAO_0000115>A crystal defect is an imperfection or irregularity in the atomic arrangement of a crystalline solid.</obo:IAO_0000115>
1120
+ <rdfs:label>Crystal Defect</rdfs:label>
1121
+ <skos:altLabel>Crystallographic Defect</skos:altLabel>
1122
+ </owl:Class>
1123
+
1124
+
1125
+
1126
+ <!-- http://purls.helmholtz-metadaten.de/cmso/CrystalStructure -->
1127
+
1128
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/CrystalStructure">
1129
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Structure"/>
1130
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Crystal structure is the arrangement of atoms or molecules in the solid state. Crystal structure also involves consideration of defects, or abnormalities, in the idealized atomic/molecular arrangements.</obo:IAO_0000115>
1131
+ <rdfs:comment>In this context, the crystal structure refers to the idealized state, while the defect information is represented elsewhere (see Crystal Defect).</rdfs:comment>
1132
+ <rdfs:label>Crystal Structure</rdfs:label>
1133
+ </owl:Class>
1134
+
1135
+
1136
+
1137
+ <!-- http://purls.helmholtz-metadaten.de/cmso/LatticeAngle -->
1138
+
1139
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/LatticeAngle">
1140
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Angle"/>
1141
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The lattice angle refers to the angles between the crystallographic axes.</obo:IAO_0000115>
1142
+ <rdfs:label>Lattice Angle</rdfs:label>
1143
+ </owl:Class>
1144
+
1145
+
1146
+
1147
+ <!-- http://purls.helmholtz-metadaten.de/cmso/LatticeParameter -->
1148
+
1149
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/LatticeParameter">
1150
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The lattice parameter is the measurement of length of the unit cell of the crystal lattice.</obo:IAO_0000115>
1151
+ <rdfs:comment>The lattice angles can also be considered lattice parameters (see Lattice Angle)</rdfs:comment>
1152
+ <rdfs:label>Lattice Parameter</rdfs:label>
1153
+ <skos:altLabel>Lattice Constant</skos:altLabel>
1154
+ </owl:Class>
1155
+
1156
+
1157
+
1158
+ <!-- http://purls.helmholtz-metadaten.de/cmso/LatticePlane -->
1159
+
1160
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/LatticePlane">
1161
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Plane"/>
1162
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">In crystallography, lattice planes are sets of parallel mathematical planes, where each lattice point is on a lattice plane. The lattice plane of a crystal is represented by three integers —h,k,l— which are referred to as the Miller indices.</obo:IAO_0000115>
1163
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Lattice Plane</rdfs:label>
1164
+ </owl:Class>
1165
+
1166
+
1167
+
1168
+ <!-- http://purls.helmholtz-metadaten.de/cmso/LatticeVector -->
1169
+
1170
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/LatticeVector">
1171
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Vector"/>
1172
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A lattice vector is a vector that defines the lattice of the crystal structure.</obo:IAO_0000115>
1173
+ <rdfs:comment>Note that it differs from the simulation cell vector.</rdfs:comment>
1174
+ <rdfs:label>Lattice Vector</rdfs:label>
1175
+ </owl:Class>
1176
+
1177
+
1178
+
1179
+ <!-- http://purls.helmholtz-metadaten.de/cmso/MacroscaleSample -->
1180
+
1181
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/MacroscaleSample">
1182
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample"/>
1183
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Macroscale sample is a computational sample in the macroscale.</obo:IAO_0000115>
1184
+ <rdfs:label>Macroscale Sample</rdfs:label>
1185
+ <skos:altLabel>Macro Scale Sample</skos:altLabel>
1186
+ </owl:Class>
1187
+
1188
+
1189
+
1190
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Material -->
1191
+
1192
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Material">
1193
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Materials are substances in the condensed states (liquid, solid, colloidal) designed or manipulated for technological ends.</obo:IAO_0000115>
1194
+ <rdfs:comment rdf:datatype="http://www.w3.org/2001/XMLSchema#string">In the CMSO context, &apos;Material&apos; refers to a theoretical entity and not necessarily a tangible object.</rdfs:comment>
1195
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Material</rdfs:label>
1196
+ </owl:Class>
1197
+
1198
+
1199
+
1200
+ <!-- http://purls.helmholtz-metadaten.de/cmso/MesoscaleSample -->
1201
+
1202
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/MesoscaleSample">
1203
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample"/>
1204
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Mesoscale sample is a computational sample in the mesoscale.</obo:IAO_0000115>
1205
+ <rdfs:label>Mesoscale Sample</rdfs:label>
1206
+ <skos:altLabel>Meso Scale Sample</skos:altLabel>
1207
+ </owl:Class>
1208
+
1209
+
1210
+
1211
+ <!-- http://purls.helmholtz-metadaten.de/cmso/MicroscaleSample -->
1212
+
1213
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/MicroscaleSample">
1214
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample"/>
1215
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Microscale sample is a computational sample in the microscale.</obo:IAO_0000115>
1216
+ <rdfs:label>Microscale Sample</rdfs:label>
1217
+ <skos:altLabel>Micro Scale Sample</skos:altLabel>
1218
+ </owl:Class>
1219
+
1220
+
1221
+
1222
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Microstructure -->
1223
+
1224
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Microstructure">
1225
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Structure"/>
1226
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The microstructure is the structure or arrangement of all components (atomic arrangement, defects, phases, etc.) of the material at the microscale.</obo:IAO_0000115>
1227
+ <rdfs:label>Microstructure</rdfs:label>
1228
+ </owl:Class>
1229
+
1230
+
1231
+
1232
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Molecule -->
1233
+
1234
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Molecule">
1235
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ChemicalSpecies"/>
1236
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">An electrically neutral entity consisting of more than one atom (n&gt;1). Rigorously, a molecule, in which n&gt;1 must correspond to a depression on the potential energy surface that is deep enough to confine at least one vibrational state.</obo:IAO_0000115>
1237
+ <obo:IAO_0000119 rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://goldbook.iupac.org/terms/view/M04002</obo:IAO_0000119>
1238
+ <rdfs:label>Molecule</rdfs:label>
1239
+ </owl:Class>
1240
+
1241
+
1242
+
1243
+ <!-- http://purls.helmholtz-metadaten.de/cmso/NanoscaleSample -->
1244
+
1245
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/NanoscaleSample">
1246
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/ComputationalSample"/>
1247
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Nanoscale sample is a computational sample in the nanoscale.</obo:IAO_0000115>
1248
+ <rdfs:label>Nanoscale Sample</rdfs:label>
1249
+ </owl:Class>
1250
+
1251
+
1252
+
1253
+ <!-- http://purls.helmholtz-metadaten.de/cmso/NormalVector -->
1254
+
1255
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/NormalVector">
1256
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Vector"/>
1257
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The normal vector is a vector perpendicular to a given object.</obo:IAO_0000115>
1258
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Normal Vector</rdfs:label>
1259
+ </owl:Class>
1260
+
1261
+
1262
+
1263
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Occupancy -->
1264
+
1265
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Occupancy">
1266
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/AtomAttribute"/>
1267
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Occupancy refers to the atom type at each lattice site.</obo:IAO_0000115>
1268
+ <rdfs:comment>Note the difference from a total ratio or percentage of the occupancy of a site in the crystal structure (as defined in CIF)</rdfs:comment>
1269
+ <rdfs:label>Occupancy</rdfs:label>
1270
+ </owl:Class>
1271
+
1272
+
1273
+
1274
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Plane -->
1275
+
1276
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Plane">
1277
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">In mathematics, a plane is a two-dimensional space or flat surface that extends indefinitely.</obo:IAO_0000115>
1278
+ <obo:OBCS_0000221 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">𝑎 𝑥 + 𝑏 𝑦 + 𝑐 𝑧 + 𝑑 = 0</obo:OBCS_0000221>
1279
+ <rdfs:comment rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The equation of a plane is 𝑎 𝑥 + 𝑏 𝑦 + 𝑐 𝑧 + 𝑑 = 0 , where 𝑎 , 𝑏 , and 𝑐 are the components of the normal vector ⃑ 𝑛 = ( 𝑎 , 𝑏 , 𝑐 ) , which is perpendicular to the plane or any vector parallel to the plane.</rdfs:comment>
1280
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Plane</rdfs:label>
1281
+ </owl:Class>
1282
+
1283
+
1284
+
1285
+ <!-- http://purls.helmholtz-metadaten.de/cmso/SimulationCell -->
1286
+
1287
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/SimulationCell">
1288
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">A simulation cell is a representation of the structure or system to be simulated. It is often a three-dimensional box (although not necessarily), where information about the crystal structure and material is contained.</obo:IAO_0000115>
1289
+ <rdfs:label>Simulation Cell</rdfs:label>
1290
+ <skos:altLabel>Box</skos:altLabel>
1291
+ <skos:altLabel>Supercell</skos:altLabel>
1292
+ </owl:Class>
1293
+
1294
+
1295
+
1296
+ <!-- http://purls.helmholtz-metadaten.de/cmso/SimulationCellAngle -->
1297
+
1298
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/SimulationCellAngle">
1299
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Angle"/>
1300
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The simulation cell angle refers to the angles of the simulation cell in each direction.</obo:IAO_0000115>
1301
+ <rdfs:label>Simulation Cell Angle</rdfs:label>
1302
+ </owl:Class>
1303
+
1304
+
1305
+
1306
+ <!-- http://purls.helmholtz-metadaten.de/cmso/SimulationCellLength -->
1307
+
1308
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/SimulationCellLength">
1309
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The simulation cell length refers to the length (dimension) of the simulation cell or box.</obo:IAO_0000115>
1310
+ <rdfs:label>Simulation Cell Length</rdfs:label>
1311
+ <skos:altLabel>Box length</skos:altLabel>
1312
+ </owl:Class>
1313
+
1314
+
1315
+
1316
+ <!-- http://purls.helmholtz-metadaten.de/cmso/SimulationCellVector -->
1317
+
1318
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/SimulationCellVector">
1319
+ <rdfs:subClassOf rdf:resource="http://purls.helmholtz-metadaten.de/cmso/Vector"/>
1320
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The simulation cell vector is a vector that defines the simulation cell or box.</obo:IAO_0000115>
1321
+ <rdfs:comment>Note that it differs from the lattice vector.</rdfs:comment>
1322
+ <rdfs:label>Simulation Cell Vector</rdfs:label>
1323
+ </owl:Class>
1324
+
1325
+
1326
+
1327
+ <!-- http://purls.helmholtz-metadaten.de/cmso/SimulationCellVolume -->
1328
+
1329
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/SimulationCellVolume">
1330
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The simulation cell volume refers to the volume of the simulation cell or box.</obo:IAO_0000115>
1331
+ <rdfs:label rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Simulation Cell Volume</rdfs:label>
1332
+ </owl:Class>
1333
+
1334
+
1335
+
1336
+ <!-- http://purls.helmholtz-metadaten.de/cmso/SpaceGroup -->
1337
+
1338
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/SpaceGroup">
1339
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The space group represents the symmetry properties of the crystal. In three-dimensions, space groups are classified in 230 distinct groups.</obo:IAO_0000115>
1340
+ <rdfs:label>Space Group</rdfs:label>
1341
+ </owl:Class>
1342
+
1343
+
1344
+
1345
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Structure -->
1346
+
1347
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Structure">
1348
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Structure is the the arrangement of particles or parts in a substance or body.</obo:IAO_0000115>
1349
+ <obo:IAO_0000119 rdf:datatype="http://www.w3.org/2001/XMLSchema#anyURI">https://www.merriam-webster.com/dictionary/structure</obo:IAO_0000119>
1350
+ <rdfs:label>Structure</rdfs:label>
1351
+ </owl:Class>
1352
+
1353
+
1354
+
1355
+ <!-- http://purls.helmholtz-metadaten.de/cmso/UnitCell -->
1356
+
1357
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/UnitCell">
1358
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">The unit cell is the smallest repeating unit of the crystal structure which contains the overal symmetry of the crystal. The entire crystal lattice can be generated by repeating the unit cell in three dimensions.</obo:IAO_0000115>
1359
+ <rdfs:label>Unit Cell</rdfs:label>
1360
+ </owl:Class>
1361
+
1362
+
1363
+
1364
+ <!-- http://purls.helmholtz-metadaten.de/cmso/Vector -->
1365
+
1366
+ <owl:Class rdf:about="http://purls.helmholtz-metadaten.de/cmso/Vector">
1367
+ <obo:IAO_0000115 rdf:datatype="http://www.w3.org/2001/XMLSchema#string">Vector is a quantity that has a magnitude and direction.</obo:IAO_0000115>
1368
+ <rdfs:label>Vector</rdfs:label>
1369
+ </owl:Class>
1370
+
1371
+
1372
+
1373
+ <!-- http://qudt.org/schema/qudt/Unit -->
1374
+
1375
+ <owl:Class rdf:about="http://qudt.org/schema/qudt/Unit">
1376
+ <terms:description rdf:datatype="http://qudt.org/schema/qudt/LatexString">A unit of measure, or unit, is a particular quantity value that has been chosen as a scale for measuring other quantities the same kind (more generally of equivalent dimension). For example, the meter is a quantity of length that has been rigorously defined and standardized by the BIPM (International Board of Weights and Measures). Any measurement of the length can be expressed as a number multiplied by the unit meter. More formally, the value of a physical quantity Q with respect to a unit (U) is expressed as the scalar multiple of a real number (n) and U, as \(Q = nU\).</terms:description>
1377
+ <rdfs:isDefinedBy rdf:resource="http://qudt.org/2.1/schema/qudt"/>
1378
+ <rdfs:label>Unit</rdfs:label>
1379
+ </owl:Class>
1380
+
1381
+
1382
+
1383
+ <!--
1384
+ ///////////////////////////////////////////////////////////////////////////////////////
1385
+ //
1386
+ // Annotations
1387
+ //
1388
+ ///////////////////////////////////////////////////////////////////////////////////////
1389
+ -->
1390
+
1391
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#Collection">
1392
+ <skos:definition xml:lang="en">A meaningful collection of concepts.</skos:definition>
1393
+ </rdf:Description>
1394
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#Concept">
1395
+ <skos:definition xml:lang="en">An idea or notion; a unit of thought.</skos:definition>
1396
+ </rdf:Description>
1397
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#ConceptScheme">
1398
+ <skos:definition xml:lang="en">A set of concepts, optionally including statements about semantic relationships between those concepts.</skos:definition>
1399
+ <skos:example xml:lang="en">Thesauri, classification schemes, subject heading lists, taxonomies, &apos;folksonomies&apos;, and other types of controlled vocabulary are all examples of concept schemes. Concept schemes are also embedded in glossaries and terminologies.</skos:example>
1400
+ </rdf:Description>
1401
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#OrderedCollection">
1402
+ <skos:definition xml:lang="en">An ordered collection of concepts, where both the grouping and the ordering are meaningful.</skos:definition>
1403
+ </rdf:Description>
1404
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#broadMatch">
1405
+ <skos:definition xml:lang="en">skos:broadMatch is used to state a hierarchical mapping link between two conceptual resources in different concept schemes.</skos:definition>
1406
+ </rdf:Description>
1407
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#broader">
1408
+ <skos:definition xml:lang="en">Relates a concept to a concept that is more general in meaning.</skos:definition>
1409
+ </rdf:Description>
1410
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#broaderTransitive">
1411
+ <skos:definition>skos:broaderTransitive is a transitive superproperty of skos:broader.</skos:definition>
1412
+ </rdf:Description>
1413
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#changeNote">
1414
+ <skos:definition xml:lang="en">A note about a modification to a concept.</skos:definition>
1415
+ </rdf:Description>
1416
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#closeMatch">
1417
+ <skos:definition xml:lang="en">skos:closeMatch is used to link two concepts that are sufficiently similar that they can be used interchangeably in some information retrieval applications. In order to avoid the possibility of &quot;compound errors&quot; when combining mappings across more than two concept schemes, skos:closeMatch is not declared to be a transitive property.</skos:definition>
1418
+ </rdf:Description>
1419
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#editorialNote">
1420
+ <skos:definition xml:lang="en">A note for an editor, translator or maintainer of the vocabulary.</skos:definition>
1421
+ </rdf:Description>
1422
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#exactMatch">
1423
+ <skos:definition xml:lang="en">skos:exactMatch is used to link two concepts, indicating a high degree of confidence that the concepts can be used interchangeably across a wide range of information retrieval applications. skos:exactMatch is a transitive property, and is a sub-property of skos:closeMatch.</skos:definition>
1424
+ </rdf:Description>
1425
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#hasTopConcept">
1426
+ <skos:definition xml:lang="en">Relates, by convention, a concept scheme to a concept which is topmost in the broader/narrower concept hierarchies for that scheme, providing an entry point to these hierarchies.</skos:definition>
1427
+ </rdf:Description>
1428
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#hiddenLabel">
1429
+ <skos:definition xml:lang="en">A lexical label for a resource that should be hidden when generating visual displays of the resource, but should still be accessible to free text search operations.</skos:definition>
1430
+ </rdf:Description>
1431
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#historyNote">
1432
+ <skos:definition xml:lang="en">A note about the past state/use/meaning of a concept.</skos:definition>
1433
+ </rdf:Description>
1434
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#inScheme">
1435
+ <skos:definition xml:lang="en">Relates a resource (for example a concept) to a concept scheme in which it is included.</skos:definition>
1436
+ </rdf:Description>
1437
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#mappingRelation">
1438
+ <skos:definition xml:lang="en">Relates two concepts coming, by convention, from different schemes, and that have comparable meanings</skos:definition>
1439
+ </rdf:Description>
1440
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#member">
1441
+ <skos:definition xml:lang="en">Relates a collection to one of its members.</skos:definition>
1442
+ </rdf:Description>
1443
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#memberList">
1444
+ <skos:definition xml:lang="en">Relates an ordered collection to the RDF list containing its members.</skos:definition>
1445
+ </rdf:Description>
1446
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#narrowMatch">
1447
+ <skos:definition xml:lang="en">skos:narrowMatch is used to state a hierarchical mapping link between two conceptual resources in different concept schemes.</skos:definition>
1448
+ </rdf:Description>
1449
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#narrower">
1450
+ <skos:definition xml:lang="en">Relates a concept to a concept that is more specific in meaning.</skos:definition>
1451
+ </rdf:Description>
1452
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#narrowerTransitive">
1453
+ <skos:definition>skos:narrowerTransitive is a transitive superproperty of skos:narrower.</skos:definition>
1454
+ </rdf:Description>
1455
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#notation">
1456
+ <skos:definition xml:lang="en">A notation, also known as classification code, is a string of characters such as &quot;T58.5&quot; or &quot;303.4833&quot; used to uniquely identify a concept within the scope of a given concept scheme.</skos:definition>
1457
+ </rdf:Description>
1458
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#related">
1459
+ <skos:definition xml:lang="en">Relates a concept to a concept with which there is an associative semantic relationship.</skos:definition>
1460
+ </rdf:Description>
1461
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#relatedMatch">
1462
+ <skos:definition xml:lang="en">skos:relatedMatch is used to state an associative mapping link between two conceptual resources in different concept schemes.</skos:definition>
1463
+ </rdf:Description>
1464
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#scopeNote">
1465
+ <skos:definition xml:lang="en">A note that helps to clarify the meaning and/or the use of a concept.</skos:definition>
1466
+ </rdf:Description>
1467
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#semanticRelation">
1468
+ <skos:definition xml:lang="en">Links a concept to a concept related by meaning.</skos:definition>
1469
+ </rdf:Description>
1470
+ <rdf:Description rdf:about="http://www.w3.org/2004/02/skos/core#topConceptOf">
1471
+ <skos:definition xml:lang="en">Relates a concept to the concept scheme that it is a top level concept of.</skos:definition>
1472
+ </rdf:Description>
1473
+ </rdf:RDF>
1474
+
1475
+
1476
+
1477
+ <!-- Generated by the OWL API (version 4.5.9.2019-02-01T07:24:44Z) https://github.com/owlcs/owlapi -->
1478
+
cmso/cmso.rst ADDED
@@ -0,0 +1,69 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ Computational Material Sample Ontology (CMSO)
2
+ ========================================================================================================================
3
+
4
+ Overview
5
+ --------
6
+ CMSO is an ontology that aims to describe computational materials science samples (or structures),
7
+ including crystalline defects. Initially focusing on the description at the atomic scale.
8
+
9
+ :Domain: Materials Science and Engineering
10
+ :Category: Materials Science
11
+ :Current Version: 0.0.1
12
+ :Last Updated: None
13
+ :Creator: https://orcid.org/0000-0001-7564-7990
14
+ :License: Creative Commons Attribution 4.0 International (CC BY 4.0)
15
+ :Format: OWL
16
+ :Download: `Computational Material Sample Ontology (CMSO) Homepage <https://github.com/OCDO/cmso/tree/main>`_
17
+
18
+ Graph Metrics
19
+ -------------
20
+ - **Total Nodes**: 347
21
+ - **Total Edges**: 556
22
+ - **Root Nodes**: 40
23
+ - **Leaf Nodes**: 192
24
+
25
+ Knowledge coverage
26
+ ------------------
27
+ - Classes: 45
28
+ - Individuals: 0
29
+ - Properties: 51
30
+
31
+ Hierarchical metrics
32
+ --------------------
33
+ - **Maximum Depth**: 2
34
+ - **Minimum Depth**: 0
35
+ - **Average Depth**: 0.56
36
+ - **Depth Variance**: 0.40
37
+
38
+ Breadth metrics
39
+ ------------------
40
+ - **Maximum Breadth**: 40
41
+ - **Minimum Breadth**: 6
42
+ - **Average Breadth**: 26.00
43
+ - **Breadth Variance**: 210.67
44
+
45
+ Dataset Statistics
46
+ ------------------
47
+ Generated Benchmarks:
48
+ - **Term Types**: 0
49
+ - **Taxonomic Relations**: 22
50
+ - **Non-taxonomic Relations**: 1
51
+ - **Average Terms per Type**: 0.00
52
+
53
+ Usage Example
54
+ -------------
55
+ .. code-block:: python
56
+
57
+ from ontolearner.ontology import CMSO
58
+
59
+ # Initialize and load ontology
60
+ ontology = CMSO()
61
+ ontology.load("path/to/ontology.OWL")
62
+
63
+ # Extract datasets
64
+ data = ontology.extract()
65
+
66
+ # Access specific relations
67
+ term_types = data.term_typings
68
+ taxonomic_relations = data.type_taxonomies
69
+ non_taxonomic_relations = data.type_non_taxonomic_relations
cmso/term_typings.json ADDED
@@ -0,0 +1 @@
 
 
1
+ []
cmso/type_non_taxonomic_relations.json ADDED
@@ -0,0 +1,16 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "types": [
3
+ "Material"
4
+ ],
5
+ "relations": [
6
+ "equivalentClass"
7
+ ],
8
+ "non_taxonomies": [
9
+ {
10
+ "ID": "NR_a664dce1",
11
+ "head": "Material",
12
+ "tail": "Material",
13
+ "relation": "equivalentClass"
14
+ }
15
+ ]
16
+ }