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Materials Data on MgU by Materials Project

MgU crystallizes in the orthorhombic Pmma space group. The structure is three-dimensional. Mg is bonded to four equivalent Mg and eight equivalent U atoms to form distorted MgMg4U8 cuboctahedra that share corners with eight equivalent UMg8U4 cuboctahedra, corners with ten equivalent MgMg4U8 cuboctahedra, edges with six equivalent MgMg4U8 cuboctahedra, edges with twelve equivalent UMg8U4 cuboctahedra, faces with eight equivalent UMg8U4 cuboctahedra, and faces with twelve equivalent MgMg4U8 cuboctahedra. There are two shorter (2.80 Å) and two longer (2.81 Å) Mg–Mg bond lengths. There are a spread of Mg–U bond distances ranging from 3.24–3.56 Å. U is bonded to eight equivalent Mg and four equivalent U atoms to form distorted UMg8U4 cuboctahedra that share corners with eight equivalent MgMg4U8 cuboctahedra, corners with ten equivalent UMg8U4 cuboctahedra, edges with six equivalent UMg8U4 cuboctahedra, edges with twelve equivalent MgMg4U8 cuboctahedra, faces with eight equivalent MgMg4U8 cuboctahedra, and faces with twelve equivalent UMg8U4 cuboctahedra. There are two shorter (2.65 Å) and two longer (2.80 Å) U–U bond lengths.

36 MATERIALS SCIENCE↗

Materials Data on Mg3U by Materials Project

Mg3U is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 8-coordinate geometry to eight equivalent Mg and six equivalent U atoms. All Mg–Mg bond lengths are 3.17 Å. There are four shorter (3.62 Å) and two longer (3.74 Å) Mg–U bond lengths. In the second Mg site, Mg is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent U atoms. All Mg–U bond lengths are 3.17 Å. U is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms.

36 MATERIALS SCIENCE↗