Self-consistent pseudopotential calculations for the electronic structure of bulk and (111) surface of α-Sn
- 10 February 1982
- journal article
- Published by IOP Publishing in Journal of Physics C: Solid State Physics
- Vol. 15 (4) , 699-706
- https://doi.org/10.1088/0022-3719/15/4/016
Abstract
Presents a self-consistent local pseudopotential calculation for the electronic structure of bulk alpha -Sn. Calculated band structure and valence charge density are compared with experiment and other theoretical results. The self-consistent pseudopotential method with a slab geometry is applied to the unreconstructed (111) surface of alpha -Sn. The results for the dangling-bond surface states on relaxed and unrelaxed surfaces are presented and compared with the works of Hirabayashi (1969), and Louis and Elices (1975).Keywords
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