Configuration Set

AFF_JCP_2022-alkane__CS_me2zvzn1iep5_0




Name AFF_JCP_2022-alkane
Extended ID AFF_JCP_2022-alkane__CS_me2zvzn1iep5_0
Description Alkane configurations from AFF_JCP_2022 dataset
Elements C (32.0%)
H (68.0%)
Number of Configurations 3,000
Number of Atoms 150,000
Configurations
Datasets DS_294zg1j9lo6j_0
ColabFit ID CS_me2zvzn1iep5_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.