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The structure of alpha-gallium and its relationship to deltahedral clusters
Uppsala University.
Uppsala University.
Uppsala University.
Uppsala University.
1997 (English)In: CHEMISTRY-A EUROPEAN JOURNAL, ISSN 0947-6539, Vol. 3, no 6, 904-911 p.Article in journal (Other scientific) Published
Abstract [en]

We present idealised geometrical models for the alpha-Ga and beta-Ga structures based on two differently distorted, corrugated 3(6) nets. We investigated the structural stability of two sets of two-dimensional and three-dimensional model structures consis

Place, publisher, year, edition, pages
WILEY-V C H VERLAG GMBH , 1997. Vol. 3, no 6, 904-911 p.
Keyword [en]
ab initio calculations; clusters; electronic structure; gallium; semiempirical calculations; INTERMETALLIC COMPOUNDS; ELEMENTAL STRUCTURES; BRILLOUIN-ZONE; SPECIAL POINTS; MAIN-GROUP; ENERGIES; MOMENTS; OPTIMIZATION; SYSTEMS; BORON
Identifiers
URN: urn:nbn:se:uu:diva-85418OAI: oai:DiVA.org:uu-85418DiVA: diva2:113326
Note
Addresses: Haussermann U, LUND UNIV, DEPT INORGAN CHEM 2, POB 124, S-22100 LUND, SWEDEN. UNIV UPPSALA, DEPT CONDENSED MATTER THEORY, S-75121 UPPSALA, SWEDEN.Available from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-15

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