Charge Density in Crystalline Arsenic
- 15 January 1970
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 1 (2) , 390-394
- https://doi.org/10.1103/physrevb.1.390
Abstract
The charge density in crystalline arsenic is calculated from orthogonalized-plane-wave wave functions and compared with the covalent-bond models due to Pauling and to Cohen, Falicov, and Golin. There is good qualitative agreement; arsenic clearly has covalent features.Keywords
This publication has 11 references indexed in Scilit:
- The crystal structure of arsenic at 4.2, 78 and 299°KJournal of Applied Crystallography, 1969
- Covalent Bond in Crystals. IV. Lattice Deformation EnergiesPhysical Review B, 1968
- Covalent Bond in Crystals. II. Partially Ionic BindingPhysical Review B, 1968
- Covalent Bond in Crystals. III. Anisotropy and Quadrupole MomentsPhysical Review B, 1968
- Covalent Bond in Crystals. I. Elements of a Structural TheoryPhysical Review B, 1968
- Fermi Surface of ArsenicPhysical Review B, 1966
- The Electronic Band Structure of Arsenic. II. Self-Consistent ApproachPhysical Review B, 1965
- Electronic Band Structure of Arsenic. I. Pseudopotential ApproachPhysical Review B, 1965
- Hartree-Fock Wave Functions for the-Shell AtomsPhysical Review B, 1961
- Dipolar Sums in the Primitive Cubic LatticesPhysical Review B, 1955