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Article
Optical Properties of Mo
Physical Review B
  • Bong-Soo Kim, Iowa State University
  • Bruce N. Harmon, Iowa State University
  • David W. Lynch, Iowa State University
Document Type
Article
Publication Date
3-1-1989
DOI
10.1103/PhysRevB.39.5754
Abstract
The interband optical conductivity of Mo was calculated using a self-consistent relativistic band structure. Including electric dipole matrix elements, the results are in excellent quantitative agreement with experiment in the 1–6-eV region. The use of nonrelativistic bands and the neglect of the dipole matrix elements each lead to poorer agreement with experiment. The major relativistic effect is the lowering of the s-like bands, not the spin-orbit splitting. k-space searches identified the regions of the Brillouin zone contributing to the three principal structures, which were found to be large volumes of the zone consisting of general points, away from symmetry points or lines.
Comments

This article is from Physical Review B 39 (1989): 5754, doi:10.1103/PhysRevB.39.5754. Posted with permission.

Copyright Owner
The American Physical Society
Language
en
File Format
application/pdf
Citation Information
Bong-Soo Kim, Bruce N. Harmon and David W. Lynch. "Optical Properties of Mo" Physical Review B Vol. 39 Iss. 9 (1989) p. 5754 - 5757
Available at: http://works.bepress.com/david_lynch1/88/