First-principles calculations on the structural and thermodynamic stability of (Na1/2Bi1/2,Ba)TiO3 and Pb(Zr,Ti)O3

Piezoelectric materials couple polarization Pα and mechanical strain εβδ [1]. The technologically most used piezoelectric material system is the ferroelectric PbZr1− xTixO3 (PZT) [2,3]. Due to the toxicity of lead oxide, and to obtain properties beyond the range of PZT [2], such as a higher temperat...

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Bibliographic Details
Main Author: Hayn, Silke
Format: Others
Language:German
en
Published: 2013
Online Access:http://tuprints.ulb.tu-darmstadt.de/3634/7/HaynAkzeptiertElektronisch.pdf
Hayn, Silke <http://tuprints.ulb.tu-darmstadt.de/view/person/Hayn=3ASilke=3A=3A.html> : First-principles calculations on the structural and thermodynamic stability of (Na1/2Bi1/2,Ba)TiO3 and Pb(Zr,Ti)O3. Technische Universität, Darmstadt [Ph.D. Thesis], (2013)