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cond-mat.mtrl-sci2004
Properties of Pb(Zr,Ti)O ultrathin films under stress-free and open-circuit electrical boundary conditions
Emad Almahmoud, Yulia Navtsenya, Igor Kornev +2
A first-principles-based scheme is developed to simulate properties of (001) PbO-terminated Pb(ZrTi)O thin films that are under stress-free and open-circuit bound…
cond-mat.mtrl-sci2004
Ultrathin films of ferroelectric solid solutions under residual depolarizing field
Igor Kornev, Huaxiang Fu, L. Bellaiche
A first-principles-derived approach is developed to study the effects of uncompensated depolarizing electric fields on the properties of Pb(Zr,Ti)O ultrathin films for differen…