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Magnetically induced crystal structure and phase stability in Fe1-cCoc
Uppsala University.
Uppsala University.
Uppsala University.
Uppsala University.
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1996 (English)In: PHYSICAL REVIEW B-CONDENSED MATTER, ISSN 0163-1829, Vol. 54, no 5, 3380-3384 p.Article in journal (Other scientific) Published
Abstract [en]

We present an ab initio determination of the crystallographic phase stability of Fe-Co alloys as a function of concentration, using the coherent potential approximation. A bcc --> hcp phase transition is found at a concentration of 85 at.% of Co, in good

Place, publisher, year, edition, pages
AMER INST PHYSICS , 1996. Vol. 54, no 5, 3380-3384 p.
Keyword [en]
GROUND-STATE PROPERTIES; GENERALIZED GRADIENT APPROXIMATION; TRANSITION-METALS; ELECTRONIC-STRUCTURE; BAND THEORY; FE-CO; ALLOYS; IRON; INSTABILITIES; DENSITY
Identifiers
URN: urn:nbn:se:uu:diva-74583OAI: oai:DiVA.org:uu-74583DiVA: diva2:102493
Note
Addresses: Abrikosov IA, UNIV UPPSALA, DEPT PHYS, CONDENSED MATTER THEORY GRP, S-75121 UPPSALA, SWEDEN. LAWRENCE LIVERMORE NATL LAB, LIVERMORE, CA 94550. TECH UNIV DENMARK, CTR ATOM SCALE MAT PHYS, DK-2800 LYNGBY, DENMARK. TECH UNIV DENMARK, DEPT PHYS, DKAvailable from: 2008-10-17 Created: 2008-10-17 Last updated: 2011-01-15

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