Configuration Set
malonaldehyde__CS_qq7qvjqk4bwl_0
| Name | malonaldehyde |
|---|---|
| Extended ID | malonaldehyde__CS_qq7qvjqk4bwl_0 |
| Description | malonaldehyde configurations from Forces-are-not-Enough dataset |
| Elements |
C (33.33%) H (44.44%) O (22.22%) |
| Number of Configurations | 20,000 |
| Number of Atoms | 180,000 |
| Configurations | |
| Datasets |
DS_u0iyfmbjyjrq_0 |
| ColabFit ID | CS_qq7qvjqk4bwl_0 |
| Files | colabfitspec.json |
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