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Full-potential optical calculations of lead chalcogenides
Uppsala University.
Uppsala University.
Uppsala University.
Uppsala University.
1998 (English)In: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, ISSN 0020-7608, Vol. 69, no 3, 349-358 p.Article in journal (Other scientific) Published
Abstract [en]

We report on ab initio calculations of the optical properties of the lead chalcogenides PbS, PbSe, and PbTe performed with a relativistic full-potential linear muffin-tin orbital method within the local density approximation. Our calculated spectra are in

Place, publisher, year, edition, pages
JOHN WILEY & SONS INC , 1998. Vol. 69, no 3, 349-358 p.
Keyword [en]
density functional theory; full-potential linear muffin-tin orbital method; optical properties; lead salts; BRILLOUIN-ZONE; SPECIAL POINTS; PBTE; PBSE; BAND
Identifiers
URN: urn:nbn:se:uu:diva-70918OAI: oai:DiVA.org:uu-70918DiVA: diva2:98829
Note
Addresses: Delin A, Univ Uppsala, Dept Phys, Box 530, S-75121 Uppsala, Sweden. Univ Uppsala, Dept Phys, S-75121 Uppsala, Sweden. Univ Calif Los Alamos Natl Lab, Ctr Mat Sci, Los Alamos, NM 87544 USA. Univ Calif Los Alamos Natl Lab, Div Theoret, Los AlamosAvailable from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-14

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