First-principles investigation of ferroelectricity in perovskite compounds
- 1 March 1994
- journal article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 49 (9) , 5828-5844
- https://doi.org/10.1103/physrevb.49.5828
Abstract
No abstract availableKeywords
This publication has 36 references indexed in Scilit:
- First principles analysis of vibrational modes in KNbO3Ferroelectrics, 1992
- Ab initiostudies on high pressure phases of icePhysical Review Letters, 1992
- Origin of ferroelectricity in perovskite oxidesNature, 1992
- Implementation of ultrasoft pseudopotentials inab initiomolecular dynamicsPhysical Review B, 1991
- Lattice dynamics and origin of ferroelectricity in: Linearized-augmented-plane-wave total-energy calculationsPhysical Review B, 1990
- Soft self-consistent pseudopotentials in a generalized eigenvalue formalismPhysical Review B, 1990
- Anharmonic elastic and phonon properties of SiPhysical Review B, 1989
- Theory of the structural phase transition of GeTePhysical Review B, 1987
- Abinitiodetermination of a structural phase transition temperaturePhysical Review Letters, 1987
- Theory of Perovskite FerroelectricsPhysical Review B, 1972