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Kunz, A.B. Cochran, Gregory Mark 2011-06-03T17:36:19Z 2011-06-03T17:36:19Z 10000-01-01 1981 The first self-consistent a.ll-electron energy band calculation of cadmium sulfide uSing ~ initio Hartree-Fock theory with nonlocal exchange is presented. Both polarization and relaxation corrections are included, and the resulting band structure is compared with the available optical data. The band gap is found to be direct and equal to 7.1 eVe No simple explanation for the anomalous diamagnetism observed experimentally is found in the calculations of the zinc-blende form. Energy band calculations are performed on zinc oxide to determine its electronic structure, and the computed bands agree with optical measurements of the valence bands. Submitted by Carolyn Rauber (crauber2@illinois.edu) on 2011-06-03T17:36:19Z No. of bitstreams: 1 1981_cochran.pdf: 1551032 bytes, checksum: 54c5eec0f2de5e045cf1cace67b4ec1b (MD5) Made available in DSpace on 2011-06-03T17:36:19Z (GMT). No. of bitstreams: 1 1981_cochran.pdf: 1551032 bytes, checksum: 54c5eec0f2de5e045cf1cace67b4ec1b (MD5) Previous issue date: 1981 Item marked as restricted to the 'UIUC Users [automated]' Group (id=2) by Carolyn Rauber (crauber2@illinois.edu) on 2011-06-03T17:36:19Z Item is restricted indefinitely. Restriction data tranferred 2014-07-01T11:14:05-05:00 Original Data Group with Access UIUC Users [automated] Release Date: none Reason: Thesis Thesis U of I Only http://hdl.handle.net/2142/25267 537461 en © Gregory Mark Cochran cadmium sulfide zinc oxide electronic energy band structures Electronic Structures of Cadmium Sulfide and Zinc Oxide Dissertation / Thesis text Physics Physics University of Illinois at Urbana-Champaign Dissertation Ph.D.