## Nature of the physical problem Restrictions on the complexity of the problem The program calculates the energy bands and electronic Limited to cubic lattices. structure ofsolids. It is written to include two different atoms per unit cell. Typical running time 9 seconds per point for a 3 by 3 S
Symmetrized program for calculating energy bands and electronic structure of solids
β Scribed by V. Hoffstein; D.K. Ray; M. Belakhovsky
- Publisher
- Elsevier Science
- Year
- 1984
- Tongue
- English
- Weight
- 40 KB
- Volume
- 35
- Category
- Article
- ISSN
- 0010-4655
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π SIMILAR VOLUMES
Title of program (32 characters maximum): VIBROT I Catalogue number: AAGC Computer for which the program is designed and others upon which it is operable Computer: IBM 360/65.
We present here a program which will calculate either the photonic band structure or the transmission and reflection coefficients of photons incident on some complex metallic or dielectric structure. The method we use is to discretise the differential form of Maxwell's equations and arrange them suc
An ab initio quasi-particle energy band structure for hexagonal boron nitride is calculated with the one-particle many-body Green function approach including core-level electrons. Both the valence and conduction band widths are calculated to be narrow compared with the Hartree-Fock (HF) band width,