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First-principle studies of a high entropy solid solution of AlCoCrCuFeNi<inf>x</inf> with different mole fractions of Ni

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Indexed by:会议论文

Date of Publication:2014-08-26

Included Journals:EI、Scopus

Volume:809-810

Page Number:419-425

Abstract:The structural properties, elastic properties, and heat of formation of a high entropy alloy (HEA) of AlCoCrCuFeNi containing different mole fraction of Ni. The calculated results indicate that the lattice parameter decreased and the mass density increased as the mole fraction of Ni increased. The high entropy solid solutions AlCoCrCuFeNi<inf>x</inf> using the FCC model are mechanically stable. The elastic properties have been deduced by Voigt-Reuss-Hill (VRH) approximations, and the calculated ratio of shear modulus to bulk modulus indicated that When the mole fraction of Ni was 0 in the FCC model, or 0.5 in both the BCC and FCC models, the high entropy solid solutions were considered ductile materials. All the HEAs are thermodynamically stable due to their negative heats of formation. ? (2015) Trans Tech Publications, Switzerland.

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