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AmirMasoud
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GMD

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molecular-dynamics

machine-learning-force-fields

compositional-generalisation

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GMD / data /Aldehydes

1 contributor

History: 1 commit

AmirMasoud's picture

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

438149d verified 4 months ago

OC10H20_PBE.traj

6.45 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC11H22_PBE.traj

6.93 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC12H24_PBE.traj

7.41 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC13H26_PBE.traj

7.89 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC14H28_PBE.traj

8.38 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC15H30_PBE.traj

8.86 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC2H4_PBE.traj

2.57 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC3H6_PBE.traj

3.06 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC4H8_PBE.traj

3.55 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC5H10_PBE.traj

4.03 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC6H12_PBE.traj

4.51 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC7H14_PBE.traj

5 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC8H16_PBE.traj

5.48 MB
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[UPLOAD] Dataset with PBE level of theory has been added 4 months ago
OC9H18_PBE.traj

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