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Application of the exact muffin-tin orbitals theory: the spherical cell approximation
Uppsala University, Disciplinary Domain of Science and Technology, Physics, Department of Physics.
2000 (English)In: COMPUTATIONAL MATERIALS SCIENCE, ISSN 0927-0256, Vol. 18, no 1, 24-38 Language: English p.Article in journal (Refereed) Published
Abstract [en]

We present a self-consistent electronic structure calculation method based on the exact muffin-tin orbitals (EMTO) theory developed by O.K. Andersen, O. Jepsen and G. Krier [in: V. Kumar, O.K. Andersen, A. Mookerjee (Eds.), Lectures on Methods of Electron

Place, publisher, year, edition, pages
ELSEVIER SCIENCE BV , 2000. Vol. 18, no 1, 24-38 Language: English p.
Keyword [en]
STRUCTURAL-PROPERTIES; GROUND-STATE; METALS; SCHEME; ENERGY; PHASE
National Category
Physical Sciences
Identifiers
URN: urn:nbn:se:uu:diva-37107OAI: oai:DiVA.org:uu-37107DiVA: diva2:65006
Note
Addresses: Vitos L, Univ Uppsala, Dept Phys, Condensed Matter Theory Grp, S-75121 Uppsala, Sweden. Univ Uppsala, Dept Phys, Condensed Matter Theory Grp, S-75121 Uppsala, Sweden. Tech Univ Denmark, Ctr Atom Scale Mat Phys, DK-2800 Lyngby, Denmark. Tech UniAvailable from: 2008-10-17 Created: 2008-10-17 Last updated: 2012-03-30

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Vitos, LeventeJohansson, Börje

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