Open AccessA fragmented, permutationally invariant polynomial approach for potential energy surfaces of large molecules: Application to N-methyl acetamide
Author(s) -
Chen Qu,
Joel M. Bowman
Publication year - 2019
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.5092794
Subject(s) - acetamide , invariant (physics) , molecule , invariant polynomial , polynomial , potential energy surface , potential energy , physics , computational chemistry , materials science , chemistry , mathematics , quantum mechanics , mathematical analysis , matrix polynomial , astrobiology
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