Self-consistent LMTO band calculations on A15 compounds
- 1 February 1979
- journal article
- Published by IOP Publishing in Journal of Physics F: Metal Physics
- Vol. 9 (2) , 283-305
- https://doi.org/10.1088/0305-4608/9/2/018
Abstract
The canonical and LMTO band methods have been used in self-consistent band calculations on 27 A15 compounds. The calculations are described and the basic results, in the form of density of state diagrams and charge analyses for each compound, are presented.Keywords
This publication has 12 references indexed in Scilit:
- Trend studies of A15 compounds by self-consistent band calculationsSolid State Communications, 1978
- Self-consistent APW bandstructure of V3GaJournal of Physics F: Metal Physics, 1978
- The electronic structure of some A15 compounds by semiself-consistent band calculationsJournal of Physics F: Metal Physics, 1977
- A technique for relativistic spin-polarised calculationsJournal of Physics C: Solid State Physics, 1977
- Advances in the theory of one-electron energy statesPhysica B+C, 1977
- Phonon properties ofsuperconductors obtained from heat-capacity measurementsPhysical Review B, 1976
- The LMTO band method applied to V3GaJournal of Physics F: Metal Physics, 1976
- Linear methods in band theoryPhysical Review B, 1975
- The electronic band structure of V3Ga. IIJournal of Physics C: Solid State Physics, 1975
- Local exchange-correlation potentialsSolid State Communications, 1971