Configuration Set

Azobenzene_inversion__CS_ld46yhezxp41_0




Name Azobenzene_inversion
Extended ID Azobenzene_inversion__CS_ld46yhezxp41_0
Description Configurations of Azobenzene relaxed through an inversion channel
Elements C (50.0%)
H (41.67%)
N (8.33%)
Number of Configurations 25,525
Number of Atoms 612,600
Configurations
Datasets DS_i23sbm1o45sj_0
ColabFit ID CS_ld46yhezxp41_0
Files colabfitspec.json

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