Heats of Adsorption of N2, CO, Ar, and CH4 versus Coverage on the Zr-Based MOF NU-1000: Measurements and DFT Calculations
Author(s) -
Graeme O. Vissers,
Wei Zhang,
Oscar Vilches,
Wei-Guang Liu,
Haoyu S. Yu,
Donald G. Truhlar,
Charles T. Campbell
Publication year - 2019
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.8b12263
Subject(s) - adsorption , chemistry , metal organic framework , density functional theory , monolayer , metal , standard enthalpy of formation , thermodynamics , analytical chemistry (journal) , computational chemistry , organic chemistry , physics , biochemistry
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