Configuration Set

xxMD-CASSCF_test_dithiophene__CS_tsjxe8a2m18r_0



Name xxMD-CASSCF_test_dithiophene
Extended ID xxMD-CASSCF_test_dithiophene__CS_tsjxe8a2m18r_0
Description Configurations of dithiophene from xxMD-CASSCF_test dataset
Elements C (50.0%)
H (40.0%)
S (10.0%)
Number of Configurations 6,200
Number of Atoms 124,000
Configurations
Datasets DS_sytg0385f79a_0
ColabFit ID CS_tsjxe8a2m18r_0
Files colabfitspec.json

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