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colabfit/JARVIS_OQMD_no_CFID
Viewer
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Updated
May 29
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812k
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3
colabfit/JARVIS_Open_Catalyst_100K
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Updated
May 29
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125k
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13
colabfit/JARVIS_QE_TB
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Updated
May 29
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830k
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41
colabfit/Matbench_mp_e_form
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Updated
May 29
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133k
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73
colabfit/Matbench_mp_gap
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Updated
May 29
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106k
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10
colabfit/OC20_S2EF_train_200K
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Updated
May 29
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200k
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12
colabfit/OC20_S2EF_val_id
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Updated
May 29
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1,000k
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55
colabfit/OC20_S2EF_val_ood_cat
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May 29
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1,000k
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21
colabfit/OC22-IS2RE-Validation-out-of-domain
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Updated
May 29
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521k
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8
colabfit/OC22-S2EF-Validation-in-domain
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Updated
May 29
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406k
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40
colabfit/OC22-S2EF-Validation-out-of-domain
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Updated
May 29
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458k
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41
colabfit/OMat24_validation_aimd-from-PBE-1000-npt
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Updated
May 29
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203k
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18
colabfit/OMat24_validation_aimd-from-PBE-1000-nvt
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Updated
May 29
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196k
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13
colabfit/OMat24_validation_rattled_1000
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Updated
May 29
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117k
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4
colabfit/QM9x
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Updated
May 29
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134k
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17
colabfit/SAIT_semiconductors_ACS_2023_HfO_raw
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Updated
May 29
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192k
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3
colabfit/SN2_JCTC_2019
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Updated
May 29
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395k
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23
colabfit/Transition1x-validation
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Updated
May 29
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265k
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48
colabfit/WS22_alanine
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Updated
May 29
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120k
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3
colabfit/WS22_nitrophenol
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Updated
May 29
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120k
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6
colabfit/WS22_sma
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Updated
May 29
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120k
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3
colabfit/WS22_urocanic
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Updated
May 29
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120k
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15
colabfit/aC_JCP_2023
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Updated
May 29
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20.2k
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4
colabfit/q-AQUA
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Updated
May 29
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120k
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4
colabfit/rMD17
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Updated
May 29
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1,000k
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4
colabfit/sAlex_validation
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Updated
May 29
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553k
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85
colabfit/xxMD-CASSCF_train
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Updated
May 29
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130k
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3
colabfit/Alexandria_geometry_optimization_paths_PBE_1D
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Updated
May 30
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665k
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12
colabfit/COMP6v2-wB97MD3BJ-def2TZVPP
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Updated
May 30
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156k
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4
colabfit/JARVIS-QM9-DGL
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Updated
May 30
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131k
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