Modeling the adsorption of short alkanes in the zeolite...

Modeling the adsorption of short alkanes in the zeolite SSZ-13 using “van der Waals” DFT exchange correlation functionals: Understanding the advantages and limitations of such functionals

Göltl, Florian, Sautet, Philippe
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Volume:
140
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.4871085
Date:
April, 2014
File:
PDF, 523 KB
english, 2014
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