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AmirMasoud
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GMD

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Tags:

molecular-dynamics

machine-learning-force-fields

compositional-generalisation

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Dataset card Files Files and versions

GMD / data /Alcohols

1 contributor

History: 1 commit

AmirMasoud's picture

[UPLOAD] Dataset with PBE level of theory has been added

438149d verified 4 months ago

OC10H22_PBE.traj

6.77 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC11H24_PBE.traj

7.25 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC12H26_PBE.traj

7.73 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC13H28_PBE.traj

8.22 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC14H30_PBE.traj

8.7 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC15H32_PBE.traj

9.18 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC2H6_PBE.traj

2.89 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC3H8_PBE.traj

3.38 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC4H10_PBE.traj

3.87 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC5H12_PBE.traj

4.35 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC6H14_PBE.traj

4.83 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC7H16_PBE.traj

5.32 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC8H18_PBE.traj

5.8 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC9H20_PBE.traj

6.28 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago