Published in
Royal Society of Chemistry, Physical Chemistry Chemical Physics, 45(20), p. 28685-28698, 2018
DOI: 10.1039/c8cp02137f
Links
Tools
Ab initio investigation of O2 adsorption on Ca-doped LaMnO3 cathodes in solid oxide fuel cells
Journal article published in 2018 by
Albert Aniagyei 
,
Nelson Y. Dzade ,
Richard Tia ,
Evans Adei,
C. R. A. Catlow,
Nora H. de Leeuw
,
Nelson Y. Dzade ,
Richard Tia ,
Evans Adei,
C. R. A. Catlow,
Nora H. de Leeuw
This paper was not found in any repository, but could be made available legally by the author.
Full text: Unavailable
Published version:
archiving forbidden
Data provided by 
Abstract
We present a Hubbard-corrected density functional theory (DFT+U) study of the adsorption and reduction reactions of oxygen on the pure and 25% Ca-doped LaMnO3 (LCM25) {100} and {110} surfaces.