Open AccessDFT-Based Cu(111)||Cu2O(111) Model for Copper Metal Covered by Ultrathin Copper Oxide: Structure, Electronic Properties, and Reactivity
Author(s) -
Fatah Chiter,
Dominique Costa,
Vincent Maurice,
Philippe Marcus
Publication year - 2020
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.0c04453
Subject(s) - copper , oxide , density functional theory , metal , copper oxide , adsorption , work function , substrate (aquarium) , materials science , electronic structure , chemistry , inorganic chemistry , chemical physics , crystallography , computational chemistry , metallurgy , oceanography , geology
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