Symmetry and band structure III. Construction of symmetrized Hamiltonian matrix

Published: 1 January 1971| Version 1 | DOI: 10.17632/csk6bxf6pb.1
V. Hoffstein, O. Moller


Title of program: SYMMETRY AND BAND STRUCTURE 3 Catalogue Id: ACMF_v1_0 Nature of problem The third section of a program to perform the symmetry part of band structure calculations. This part constructs symmetrized plane waves and evaluates matrix elements between them. Versions of this program held in the CPC repository in Mendeley Data ACMF_v1_0; SYMMETRY AND BAND STRUCTURE 3; 10.1016/0010-4655(71)90011-7 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)



Surface Science, Condensed Matter Physics, Computational Physics