Open AccessA potential for molecular simulation of compounds with linear moieties
Author(s) -
David van der Spoel,
Henning Henschel,
Paul J. van Maaren,
Mohammad Mehdi Ghahremanpour,
Luciano T. Costa
Publication year - 2020
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 - 10.1063/5.0015184
Subject(s) - potential energy , molecular geometry , chemistry , position (finance) , lennard jones potential , harmonic , perturbation (astronomy) , molecule , molecular dynamics , computational chemistry , molecular physics , physics , atomic physics , quantum mechanics , organic chemistry , finance , economics
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