Hybrid functional calculations of point defects and hydrogen in SrZrO 3

TitleHybrid functional calculations of point defects and hydrogen in SrZrO 3
Publication TypeJournal Article
Year of Publication2014
AuthorsWeston L, Janotti A, Cui XY, Stampfl C, Van de Walle CG
JournalPhysical Review B
Volume89
Pagination184109
Grant: 
MRI R2 (CNS-0960316), CSC, MRL (DMR-1121053)