Predicting gas selectivity in organic ionic plastic crystals by free energy calculations
Version 2 2024-06-04, 15:06
Version 1 2021-06-09, 08:10
journal contribution
posted on 2021-01-01, 00:00 authored by V S Kandagal, Jenny PringleJenny Pringle, Maria ForsythMaria Forsyth, Fangfang ChenFangfang ChenThe free energy calculation shows the different free energy changes of the adsorption and absorption of gas molecules into an organic ionic plastic crystal, successfully predicting the gas selectivity of this new type of gas separation material.
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Journal
RSC advancesVolume
11Issue
32Pagination
19623 - 19629Publisher
Royal Society of ChemistryLocation
Cambridge, Eng.Publisher DOI
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eISSN
2046-2069Language
engPublication classification
C1 Refereed article in a scholarly journalUsage metrics
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