Calculation of the green's function for a crystal surface or interface

Published: 1 January 1985| Version 1 | DOI: 10.17632/b8rbfmsy6z.1
Frantis̆ek Máca, Matthias Scheffler


Title of program: SURFACE GREEN'S FUNCTION Catalogue Id: AADF_v1_0 Nature of problem The computer code described in this paper allows the calculation of the Green's function of a three-dimensional system with two-dimensional translational symmetry. Examples for its application are the crystal surface and the interface between two crystals. The Green's function contains detailed information about the electronic structure. It directly allows to evaluate the surface electron charge density and the local and projected density of states. It is also a key factor determining the photoe ... Versions of this program held in the CPC repository in Mendeley Data AADF_v1_0; SURFACE GREEN'S FUNCTION; 10.1016/0010-4655(85)90108-0 AADF_v2_0; SURFACE GREEN'S FUNCTION VER. 2; 10.1016/0010-4655(87)90119-6 AADF_v3_0; RUMPGF; 10.1016/0010-4655(88)90151-8 AADF_v4_0; fhi93g0; 10.1016/0010-4655(94)00127-N 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