pyIAST: Ideal adsorbed solution theory (IAST) Python package

Ideal adsorbed solution theory (IAST) is a widely-used thermodynamic framework to readily predict mixed-gas adsorption isotherms from a set of pure-component adsorption isotherms. We present an open-source, user-friendly Python package, pyIAST, to perform IAST calculations for an arbitrary number of...

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Bibliographic Details

Published in:	Computer physics communications Vol. 200; no. C; pp. 364 - 380
Main Authors:	Simon, Cory M., Smit, Berend, Haranczyk, Maciej
Format:	Journal Article
Language:	English
Published:	Netherlands Elsevier B.V 01.03.2016 Elsevier
Subjects:	Adsorption Computer simulation IAST Ideal adsorbed solution theory Isotherms Mathematical analysis Mathematical models Mixed-gas adsorption Packages Source code Summaries Mixed-gas adsorption Ideal adsorbed solution theory IAST
ISSN:	0010-4655, 1879-2944
Online Access:	Get full text
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