Open AccessAb Initio Simulation Explains the Enhancement of Catalytic Oxygen Evolution on CaMnO3
Author(s) -
Tian Qiu,
Bingtian Tu,
Diomedes SaldanaGreco,
Andrew M. Rappe
Publication year - 2018
Publication title -
acs catalysis
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 4.898
H-Index - 198
ISSN - 2155-5435
DOI - 10.1021/acscatal.7b03987
Subject(s) - overpotential , catalysis , oxygen evolution , chemical physics , perovskite (structure) , density functional theory , ab initio , oxygen , materials science , chemical engineering , chemistry , computational chemistry , crystallography , electrochemistry , biochemistry , organic chemistry , electrode , engineering
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