Effect of Single-Layer MoS2 on the Geometry, Electronic Structure, and Reactivity of Transition Metal Nanoparticles
Author(s) -
Takat B. Rawal,
Duy Le,
Talat S. Rahman
Publication year - 2017
Publication title -
the journal of physical chemistry c
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.401
H-Index - 289
eISSN - 1932-7455
pISSN - 1932-7447
DOI - 10.1021/acs.jpcc.7b00036
Subject(s) - density functional theory , dissociation (chemistry) , ab initio , binding energy , fermi level , nanoparticle , transition metal , vacancy defect , adsorption , chemical physics , electronic structure , metal , reactivity (psychology) , materials science , chemistry , molecular orbital , atom (system on chip) , crystallography , computational chemistry , atomic physics , nanotechnology , molecule , catalysis , electron , alternative medicine , pathology , biochemistry , quantum mechanics , metallurgy , medicine , physics , organic chemistry , computer science , embedded system
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