Open AccessMolecular Simulation of Capture of Sulfur-Containing Gases by Porous Aromatic Frameworks
Author(s) -
Difan Zhang,
Xiaofei Jing,
David S. Sholl,
Susan B. Sinnott
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.8b03767
Subject(s) - adsorption , selectivity , chemistry , molecule , density functional theory , porosity , thermodynamics , computational chemistry , organic chemistry , catalysis , physics
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