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Published in 2018 at "Adsorption"
DOI: 10.1007/s10450-018-9932-7
Abstract: Density functional theory has been used to investigate the adsorption and dissociation of 5-hydroxy-3-hexanediol-1,4-naphthaquinone (Jug-C4-thiol) at a coverage of p(4 × 4) on a Au(111) surface. Both physisorption and chemisorption processes are investigated. For each process, the…
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Keywords:
adsorption dissociation;
adsorption;
dissociation hydroxy;
surface ... See more keywords