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DOE OSTI · 1726652

Materials Data on AlV3 by Materials Project

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Abstract

V3Al is Tungsten-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are two inequivalent V sites. In the first V site, V is bonded in a distorted body-centered cubic geometry to six V and two equivalent Al atoms. There are two shorter (2.57 Å) and four longer (2.64 Å) V–V bond lengths. Both V–Al bond lengths are 2.67 Å. In the second V site, V is bonded in a distorted body-centered cubic geometry to eight V atoms. All V–V bond lengths are 2.64 Å. Al is bonded in a distorted body-centered cubic geometry to four equivalent V and four equivalent Al atoms. All Al–Al bond lengths are 2.64 Å.

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36 MATERIALS SCIENCEAl-VAlV3crystal structure

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2019-01-13. Materials Data on AlV3 by Materials Project. https://doi.org/10.17188/1726652

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