Open AccessAssessing the Predictive Power of Density Functional Theory in Finite-Temperature Hydrogen Adsorption/Desorption Thermodynamics
Author(s) -
Yungok Ihm,
Changwon Park,
Jacek Jakowski,
James R. Morris,
Ji Hoon Shim,
YongHyun Kim,
Bobby G. Sumpter,
Mina Yoon
Publication year - 2018
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.8b00793
Subject(s) - adsorption , density functional theory , thermodynamics , desorption , hydrogen , chemistry , materials science , computational chemistry , physics , organic chemistry
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