Phenol adsorption mechanism on the zinc oxide surface: Experimental, cluster DFT calculations, and molecular dynamics simulations
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Title
Phenol adsorption mechanism on the zinc oxide surface: Experimental, cluster DFT calculations, and molecular dynamics simulations
Authors
Keywords
Phenol, Adsorption, Zinc oxide, DFT, Molecular dynamics
Journal
JOURNAL OF MOLECULAR LIQUIDS
Volume 324, Issue -, Pages 114993
Publisher
Elsevier BV
Online
2020-12-10
DOI
10.1016/j.molliq.2020.114993
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