Title: Phase stability during martensitic transformation in ZrCu intermetallics: crystal and electronic structure aspects
Authors: Firstov, G.S.
Timoshevskii, A.N.
Koval, Yu.N.
Kalkuta, S.
Van Humbeeck, Jan
Issue Date: 2009
Publisher: EDP Sciences, 2009
Host Document: Proc. ESOMAT 2009 pages:1-8
Conference: ESOMAT 2009, The 8th European Symposium on Martensitic Transformations location:Prague, Czech Republic date:7-11 September 2009
Article number: 02008
Abstract: This article is dedicated to the estimation of the relative stability for B2, B19` and Cm phase in ZrCu intermetallic compound through the ab-initio electronic structure calculations and subsequent crystal structure Rietveld refinement. The information about electronic and crystal structure of phases in ZrCu will allow selecting for this high temperature shape memory alloy such alloying elements that will significantly improve shape memory behavior through definite structural changes.
Publication status: published
KU Leuven publication type: IC
Appears in Collections:Physical Metallurgy and Materials Engineering Section (-)

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