Dependence of Phonon Frequencies on the Pseudopotential Form Factor for Aluminum
- 15 November 1969
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 187 (3) , 991-993
- https://doi.org/10.1103/PhysRev.187.991
Abstract
The phonon frequencies were calculated for aluminum from a theory based on Coulomb interactions among the ions, Born-Mayer repulsion between nearest-neighbor ion cores, and a local pseudopotential interaction between ions and conduction electrons. For both a Harrison modified point-ion potential and a local Heine-Abarenkov potential, the parameters of the theory were determined to give the best over-all fit to the measured phonon dispersion curves. For the two pseudopotentials so determined, the Born-Mayer repulsion was found to be negligible, the screened form factors are the same for and are in good agreement with Fermi-surface data, and the calculated phonon frequencies are the same. The calculated frequencies depend sensitively on for , and also depend strongly on some average of for larger .
Keywords
This publication has 16 references indexed in Scilit:
- Pseudopotential Calculation of the Elastic Constants of Simple MetalsPhysical Review B, 1969
- Pseudopotential Calculation of Phonon Frequencies and Grüneisen Parameters for LithiumPhysical Review B, 1969
- Pseudopotential Calculation of the Thermal Expansion Coefficient of Sodium and PotassiumPhysical Review B, 1968
- Lattice-Dynamic Calculation for Alkali MetalsPhysical Review B, 1968
- Phonon-Frequency Distributions and Heat Capacities of Aluminum and LeadPhysical Review B, 1967
- Crystal Dynamics of Potassium. I. Pseudopotential Analysis of Phonon Dispersion Curves at 9°KPhysical Review B, 1966
- The phonon spectra of alkali metals and aluminiumIl Nuovo Cimento B (1971-1996), 1966
- A calculation of the phonon frequencies in sodiumProceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1965
- A new method for the electronic structure of metalsPhilosophical Magazine, 1964
- The description of collective motions in terms of many-body perturbation theory. II. The correlation energy of a free-electron gasProceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1958