Configuration Set

xxMD-DFT_validation_malonaldehyde__CS_346fs8xtkrfh_0



Name xxMD-DFT_validation_malonaldehyde
Extended ID xxMD-DFT_validation_malonaldehyde__CS_346fs8xtkrfh_0
Description Configurations of malonaldehyde from xxMD-DFT_validation dataset
Elements C (33.33%)
H (44.44%)
O (22.22%)
Number of Configurations 6,963
Number of Atoms 62,667
Configurations
Datasets DS_d1nmrzy4csx1_0
ColabFit ID CS_346fs8xtkrfh_0
Files colabfitspec.json

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