Transactions of Nonferrous Metals Society of China The Chinese Journal of Nonferrous Metals

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中國有色金屬學(xué)報(英文版)

Transactions of Nonferrous Metals Society of China

Vol. 23    No. 10    October 2013

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Experimental and first-principles investigation of crystal structure of powder metallurgy Al-1.1Sc and Al-2Sc alloys
Hamza Ya?ar OCAK1, Ercan U?GUN1, Rahmi üNAL2

1. Department of Physics, Faculty of Arts and Sciences, Dumlupinar University, Kutahya, Turkey;
2. Mechanical Engineering Department, Engineering Faculty, Gazi University, Ankara, Turkey

Received 7 January 2013; accepted 25 March 2013

Abstract:Al-1.1%Sc and Al-2%Sc (mass fraction) alloys were prepared using gas atomized alloy particles. Samples from consolidated alloys were analyzed by XRD for the determination of lattice parameters. Using these lattice parameters, the mechanical properties of the alloys were calculated theoretically with WIEN2k and EMTO programs, respectively. The elasticity moduli of the experimentally produced alloys were compared with the theoretical calculation results. The calculated mechanical properties of Al3Sc phase and Al-Sc alloys were discussed to determine the optimum Sc content of Al-Sc alloys. It may be concluded that the Sc content should be the maximum about 1.0%, much more Sc addition could not improve the mechanical properties of the alloys.

 

Key words: Al-Sc alloy; lattice constant; elastic properties; Ab initio calculations; first principles

ISSN 1004-0609
CN 43-1238/TG
CODEN: ZYJXFK

ISSN 1003-6326
CN 43-1239/TG
CODEN: TNMCEW

主管:中國科學(xué)技術(shù)協(xié)會 主辦:中國有色金屬學(xué)會 承辦:中南大學(xué)
湘ICP備09001153號 版權(quán)所有:《中國有色金屬學(xué)報》編輯部
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