6533b82cfe1ef96bd1290372
RESEARCH PRODUCT
Ab initio simulation of (Ba,Sr)TiO3 and (Ba,Ca)TiO3 perovskite solid solutions
Leonid L. RusevichGuntars ZvejnieksEugene A. Kotominsubject
First-principles computationAb initio:NATURAL SCIENCES:Physics [Research Subject Categories]Density functional theory (DFT)Perovskite solid solutionLead-free piezoelectricdescription
This research was supported by the ERA-NET HarvEnPiez project. Many thanks to R. Dovesi, M.M. Kržmanc and D. Gryaznov for fruitful discussions.
| year | journal | country | edition | language |
|---|---|---|---|---|
| 2019-01-01 |