Configuration Set


Name xxMD-DFT_train_dithiophene
Extended ID xxMD-DFT_train_dithiophene__CS_5j254y9lfa7v_0
Description Configurations of dithiophene from xxMD-DFT_train dataset
Elements C (50.0%)
H (40.0%)
S (10.0%)
Number of Configurations 12,394
Number of Atoms 247,880
Datasets DS_fblez5twbr07_0
ColabFit ID CS_5j254y9lfa7v_0
Files colabfitspec.json

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