Configuration Set


Name xxMD-CASSCF_test_azobenzene
Extended ID xxMD-CASSCF_test_azobenzene__CS_k3k3tmavdrdc_0
Description Configurations of azobenzene from xxMD-CASSCF_test dataset
Elements C (50.0%)
H (41.67%)
N (8.33%)
Number of Configurations 2,100
Number of Atoms 50,400
Datasets DS_sytg0385f79a_0
ColabFit ID CS_k3k3tmavdrdc_0
Files colabfitspec.json

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