Configuration Set

ORCA__CS_bojf245vdzae_0



Name ORCA
Extended ID ORCA__CS_bojf245vdzae_0
Description Configurations from the mbGDML set predicted using ORCA
Elements H (61.54%)
O (16.24%)
C (17.09%)
N (5.13%)
Number of Configurations 12,503
Number of Atoms 351,090
Configurations
Datasets DS_cz3fqphrrlr6_0
ColabFit ID CS_bojf245vdzae_0
Files colabfitspec.json

No uploaded content is transferred in ownership from the original creators to ColabFit. All content is distributed under the license specified by its contributor who has stated that he or she has the authority to share it under the specified license.