colabfit/In2Se3_2D_DPGEN · Datasets at Hugging Face

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

20

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3

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1

VASP

DFT-PBE

null

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null

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true

null

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null

0.785657

1.55661

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MD_2726573268070736046235160

2024-08-16T15:13:56

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PO_4831599649406261869941441

null

[ "init.003_set.006_192" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1000107171173871553441832

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

11,521

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233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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1

VASP

DFT-PBE

null

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null

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MD_2726573268070736046235160

2024-08-16T14:55:23

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PO_1115539615463460646611856

null

[ "data.031_set.000_29" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1001708695029675768654932

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

11,521

0

11,521

-74.308979

233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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1

VASP

DFT-PBE

null

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true

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MD_2726573268070736046235160

2024-08-16T14:33:42

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PO_6553275962162435385049205

null

[ "data.110_set.000_163" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1002060621619308266786312

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

11,521

0

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233.249989

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2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

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[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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MD_2726573268070736046235160

2024-08-16T14:43:27

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null

[ "data.013_set.000_36" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1002127985495802210381198

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

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2023-12-01T22:59:36

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[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

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DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T14:39:09

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null

[ "data.045_set.000_80" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1004328550230179125018636

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

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233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T15:17:36

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PO_1171414339888712946291554

null

[ "data.110_set.000_81" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1004930490271420593887669

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

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11,521

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2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

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[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

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MD_2726573268070736046235160

2024-08-16T15:29:27

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2023-12-02T03:57:46

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CO_1005037826350413802162681

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

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MD_2726573268070736046235160

2024-08-16T15:10:35

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2023-12-02T03:57:45

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CO_1005046098198669852819200

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

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2023-12-01T22:59:36

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LGPL-3.0-only

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10.60732/a8e05a1b

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In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

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In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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MD_2726573268070736046235160

2024-08-16T14:13:29

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2023-12-02T03:57:46

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CO_1006511336699499506312887

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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2023-12-02T03:57:46

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CO_1006739092026441902264705

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

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MD_2726573268070736046235160

2024-08-16T14:13:39

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2023-12-02T03:57:46

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CO_1008969998834237885187944

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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MD_2726573268070736046235160

2024-08-16T14:13:52

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null

[ "init.020_set.000_46" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1009030724583478173037874

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

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DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T14:12:16

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2023-12-02T03:57:46

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CO_1010537711421704040372533

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

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LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T14:46:30

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2023-12-02T03:57:46

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CO_1010796194886552363272381

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

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DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T14:58:59

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[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1010845943847249682461547

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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VASP

DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T15:23:43

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null

[ "data.014_set.000_44" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1011020266578039631466285

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

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11,521

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233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In2Se3

A3B2

[ 49, 49, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

5

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[ true, true, true ]

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VASP

DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T14:51:58

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null

[ "init.007_set.000_66" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1011579812226353935292747

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

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0

2023-12-01T22:59:36

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[ 3 ]

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[ 0.4, 0.6 ]

LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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[ true, true, true ]

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3

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VASP

DFT-PBE

null

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null

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MD_2726573268070736046235160

2024-08-16T15:22:49

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PO_8116574030401341586516632

null

[ "data.031_set.000_5" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1011694788867605304887549

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

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233.249989

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2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

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VASP

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null

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MD_2726573268070736046235160

2024-08-16T14:13:07

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2023-12-02T03:57:46

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CO_1012016368863807132649262

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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MD_2726573268070736046235160

2024-08-16T14:12:38

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2023-12-02T03:57:46

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CO_1012095316508597139142480

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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2023-12-01T22:59:36

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LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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MD_2726573268070736046235160

2024-08-16T15:25:37

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2023-12-02T03:57:46

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CO_1012444250748891890103817

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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MD_2726573268070736046235160

2024-08-16T14:29:58

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null

[ "data.084_set.000_70" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1013251458235270758949279

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

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233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

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VASP

DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T15:21:20

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PO_1115610458936210037857494

null

[ "data.057_set.000_98" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1013700029535707362225994

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

11,521

0

11,521

-74.308979

233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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[ true, true, true ]

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1

VASP

DFT-PBE

null

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MD_2726573268070736046235160

2024-08-16T14:12:21

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null

[ "data.050_set.000_76" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:46

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CO_1014553482161836886520818

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

11,521

0

11,521

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233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

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DFT-PBE

null

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null

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MD_2726573268070736046235160

2024-08-16T14:15:50

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null

[ "data.056_set.000_90" ]

[ "DS_v4e6t79tt5xh_0" ]

2023-12-02T03:57:45

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CO_1015219381310627229976618

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

2

11,521

11,523

248,510

0

11,521

0

11,521

0

11,521

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233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

[ "In", "Se" ]

[ 0.4, 0.6 ]

2

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MD_2726573268070736046235160

2024-08-16T15:23:50

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2023-12-02T03:57:45

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CO_1015696794386826944202634

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

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LGPL-3.0-only

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10.60732/a8e05a1b

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DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In8Se12

In2Se3

A3B2

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MD_2726573268070736046235160

2024-08-16T14:13:56

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2023-12-02T03:57:46

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CO_1016170383489354891033870

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

[ "In", "Se" ]

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LGPL-3.0-only

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10.60732/a8e05a1b

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In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

In12Se18

In2Se3

A3B2

[ 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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MD_2726573268070736046235160

2024-08-16T15:25:57

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2023-12-02T03:57:46

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CO_1017429666234473964063239

In2Se3_2D_DPGEN

[ "Jing Wu", "Liyi Bai", "Jiawei Huang", "Liyang Ma", "Jian Liu", "Shi Liu" ]

Approximately 11,500 configurations of In2Se3, including monolayer (20-atom slab) and bulk (30-atom supercell) models.

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233.249989

0

2023-12-01T22:59:36

[ [ 1, 1, 1 ] ]

[ 3 ]

2023

[ 0.4, 0.6 ]

LGPL-3.0-only

{'source-publication': 'https://doi.org/10.1103/PhysRevB.104.174107', 'source-data': 'https://www.aissquare.com/datasets/detail?pageType=datasets&name=In2Se3-2D-dpgen', 'other': None}

10.60732/a8e05a1b

8942864378022192444443727081797465040655803883072156950818683993363018377737438160806544940374156692128686505011353768757271189810760464382869111140262573

DS_v4e6t79tt5xh_0

In2Se3_2D_DPGEN__Wu-Bai-Huang-Ma-Liu-Liu__DS_v4e6t79tt5xh_0

Datasets:

colabfit
/

In2Se3_2D_DPGEN

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