Open AccessStrain-Induced Phase and Oxygen-Vacancy Stability in Ionic Interfaces from First-Principles Calculations
Author(s) -
Dilpuneet S. Aidhy,
Bin Liu,
Yanwen Zhang,
William J. Weber
Publication year - 2014
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/jp507876m
Subject(s) - vacancy defect , materials science , orthorhombic crystal system , fluorite , density functional theory , columbite , ionic bonding , phase (matter) , oxygen , strain (injury) , chemical physics , crystallography , condensed matter physics , ion , computational chemistry , chemistry , composite material , crystal structure , metallurgy , physics , medicine , organic chemistry , ceramic
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