Configuration Set


Name ANI-2x-wB97X-631Gd_num_atoms_62
Extended ID ANI-2x-wB97X-631Gd_num_atoms_62__CS_alg75kaor2o1_0
Description Configurations with 62 atoms from ANI-2x-wB97X-631Gd dataset
Elements C (31.45%)
H (59.68%)
N (3.23%)
O (5.65%)
Number of Configurations 2
Number of Atoms 124
Configurations CO_781910832353714026
Datasets DS_rde4chkdmm18_0
ColabFit ID CS_alg75kaor2o1_0
Files colabfitspec.json

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