Open AccessHindered Translator and Hindered Rotor Models for Adsorbates: Partition Functions and Entropies
Author(s) -
Lynza H. Sprowl,
Charles T. Campbell,
Líney Árnadóttir
Publication year - 2016
Publication title -
the journal of physical chemistry c
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.401
H-Index - 289
eISSN - 1932-7455
pISSN - 1932-7447
DOI - 10.1021/acs.jpcc.5b11616
Subject(s) - rigid rotor , chemistry , moment of inertia , harmonic oscillator , adiabatic process , quantum , density functional theory , potential energy surface , statistical physics , thermodynamics , molecule , atomic physics , physics , quantum mechanics , rotor (electric) , computational chemistry
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