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Get Free AccessThe functional groups exhibit a dual influence on the covalent and non-covalent interactions between MBT and the Cu(111) surface via robust correlation with the Hammett substituent constant and substitution interaction energy, respectively.
Thanh Hai Pham, Viorel Chihaia, Do Ngoc Son (2024). Unravelling the effects of functional groups on the adsorption of 2-mercaptobenzothiazole on a copper surface: a DFT study. Physical Chemistry Chemical Physics, 26(24), pp. 17345-17358, DOI: 10.1039/d4cp00988f.
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Type
Article
Year
2024
Authors
3
Datasets
0
Total Files
0
Language
English
Journal
Physical Chemistry Chemical Physics
DOI
10.1039/d4cp00988f
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