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Understanding Adsorption of Organics on Pt(111) in the Aqueous Phase: Insights from DFT Based Implicit Solvent and Statistical Thermodynamics Models.

Authors :
Bramley, Gabriel A.
Nguyen, Manh-Thuong
Glezakou, Vassiliki-Alexandra
Rousseau, Roger
Skylaris, Chris-Kriton
Source :
Journal of Chemical Theory & Computation; 3/8/2022, Vol. 18 Issue 3, p1849-1861, 13p
Publication Year :
2022

Details

Language :
English
ISSN :
15499618
Volume :
18
Issue :
3
Database :
Supplemental Index
Journal :
Journal of Chemical Theory & Computation
Publication Type :
Academic Journal
Accession number :
155998445
Full Text :
https://doi.org/10.1021/acs.jctc.1c00894