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DOE OSTI · 1187223

Materials Data on Y3SnC by Materials Project

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Abstract

Y3SnC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Y is bonded in a linear geometry to four equivalent Sn and two equivalent C atoms. All Y–Sn bond lengths are 3.46 Å. Both Y–C bond lengths are 2.45 Å. Sn is bonded to twelve equivalent Y atoms to form SnY12 cuboctahedra that share corners with twelve equivalent SnY12 cuboctahedra, faces with six equivalent SnY12 cuboctahedra, and faces with eight equivalent CY6 octahedra. C is bonded to six equivalent Y atoms to form CY6 octahedra that share corners with six equivalent CY6 octahedra and faces with eight equivalent SnY12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

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36 MATERIALS SCIENCEC-Sn-Ycrystal structureY3SnC

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2020-07-16. Materials Data on Y3SnC by Materials Project. https://doi.org/10.17188/1187223

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