Structural and electronic properties of half-Heusler alloys PtXBi (with X=Mn, Fe, Co and Ni) calculated from first principles

Wenchao Huang; Xiaofang Wang; Xiaohong Chen; Wei Lü; L. Damewood; C. Y. Fong

doi:10.1016/j.jmmm.2014.10.068

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Structural and electronic properties of half-Heusler alloys PtXBi (with X=Mn, Fe, Co and Ni) calculated from first principles

Wenchao Huang Xiaofang Wang Xiaohong Chen Wei Lü L. Damewood C. Y. Fong

Year: 2014 Journal: Journal of Magnetism and Magnetic Materials Vol: 377 Pages: 252-258 Publisher: Elsevier BV

DOI: 10.1016/j.jmmm.2014.10.068

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Keywords:

Magnetic moment Lattice constant Materials science Condensed matter physics Density functional theory Spin polarization Metal Valence (chemistry) Electronic structure Transition metal Physics Electron Computational chemistry Chemistry Quantum mechanics

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Heusler alloys: electronic and magnetic properties

Physical Sciences → Materials Science → Electronic, Optical and Magnetic Materials

Intermetallics and Advanced Alloy Properties

Physical Sciences → Engineering → Mechanical Engineering

MXene and MAX Phase Materials

Physical Sciences → Materials Science → Materials Chemistry

Structural and electronic properties of half-Heusler alloys PtXBi (with X=Mn, Fe, Co and Ni) calculated from first principles

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