A Projector Augmented Wave (PAW) code for electronic structure calculations, Part II: pwpaw for periodic solids in a plane wave basis
- 15 April 2001
- journal article
- Published by Elsevier BV in Computer Physics Communications
- Vol. 135 (3), 348-376
- https://doi.org/10.1016/s0010-4655(00)00241-1
Abstract
No abstract availableKeywords
This publication has 23 references indexed in Scilit:
- A Projector Augmented Wave (PAW) code for electronic structure calculations, Part I: atompaw for generating atom-centered functionsComputer Physics Communications, 2001
- The Projector-Augmented Plane Wave Method Applied to Molecular BondingThe Journal of Physical Chemistry A, 1999
- From ultrasoft pseudopotentials to the projector augmented-wave methodPhysical Review B, 1999
- Comparison of the projector augmented-wave, pseudopotential, and linearized augmented-plane-wave formalisms for density-functional calculations of solidsPhysical Review B, 1997
- Local-density-derived semiempirical pseudopotentialsPhysical Review B, 1995
- Projector augmented-wave methodPhysical Review B, 1994
- Core-cancellation functions for evaluating exchange-correlation functionals in first-principles pseudopotential calculationsPhysical Review B, 1994
- Super-matrix methodsComputer Physics Communications, 1989
- Self-Consistent Equations Including Exchange and Correlation EffectsPhysical Review B, 1965
- Inhomogeneous Electron GasPhysical Review B, 1964