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DOE OSTI · 1729506

Materials Data on Mn3AuN by Materials Project

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Abstract

Mn3AuN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mn is bonded in a linear geometry to four equivalent Au and two equivalent N atoms. All Mn–Au bond lengths are 2.70 Å. Both Mn–N bond lengths are 1.91 Å. Au is bonded to twelve equivalent Mn atoms to form AuMn12 cuboctahedra that share corners with twelve equivalent AuMn12 cuboctahedra, faces with six equivalent AuMn12 cuboctahedra, and faces with eight equivalent NMn6 octahedra. N is bonded to six equivalent Mn atoms to form NMn6 octahedra that share corners with six equivalent NMn6 octahedra and faces with eight equivalent AuMn12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

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36 MATERIALS SCIENCEAu-Mn-Ncrystal structureMn3AuN

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2020-05-02. Materials Data on Mn3AuN by Materials Project. https://doi.org/10.17188/1729506

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