Generalized-gradient-approximation description of band splittings in transition-metal oxides and fluorides
- 15 April 1994
- journal article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 49 (15) , 10170-10175
- https://doi.org/10.1103/physrevb.49.10170
Abstract
No abstract availableThis publication has 28 references indexed in Scilit:
- Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlationPhysical Review B, 1992
- Gradient-corrected density-functional studies ofPhysical Review B, 1991
- Electronic structure of the high-temperature oxide superconductorsReviews of Modern Physics, 1989
- Density-functional exchange-energy approximation with correct asymptotic behaviorPhysical Review A, 1988
- Accurate and simple density functional for the electronic exchange energy: Generalized gradient approximationPhysical Review B, 1986
- Theory of Magnetic and Structural Ordering in IronPhysical Review Letters, 1985
- Band theory of insulating transition-metal monoxides: Band-structure calculationsPhysical Review B, 1984
- Beyond the local-density approximation in calculations of ground-state electronic propertiesPhysical Review B, 1983
- Self-Consistent Equations Including Exchange and Correlation EffectsPhysical Review B, 1965
- Inhomogeneous Electron GasPhysical Review B, 1964