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Materials Data on SmGaCo by Materials Project

SmCoGa crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are two inequivalent Sm sites. In the first Sm site, Sm is bonded in a 1-coordinate geometry to four Co and six Ga atoms. There are a spread of Sm–Co bond distances ranging from 2.66–3.06 Å. There are a spread of Sm–Ga bond distances ranging from 3.07–3.33 Å. In the second Sm site, Sm is bonded in a 1-coordinate geometry to four Co and six Ga atoms. There are a spread of Sm–Co bond distances ranging from 2.65–3.06 Å. There are a spread of Sm–Ga bond distances ranging from 3.07–3.33 Å. There are two inequivalent Co sites. In the first Co site, Co is bonded in a 9-coordinate geometry to four Sm, two equivalent Co, and three equivalent Ga atoms. Both Co–Co bond lengths are 2.48 Å. There are one shorter (2.39 Å) and two longer (2.43 Å) Co–Ga bond lengths. In the second Co site, Co is bonded in a 9-coordinate geometry to four Sm, two equivalent Co, and three equivalent Ga atoms. Both Co–Co bond lengths are 2.48 Å. There are one shorter (2.39 Å) and two longer (2.43 Å) Co–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 6-coordinate geometry to six Sm and three equivalent Co atoms. In the second Ga site, Ga is bonded in a 6-coordinate geometry to six Sm and three equivalent Co atoms.

36 MATERIALS SCIENCE↗

Materials Data on SmGaCo by Materials Project

SmCoGa crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sm is bonded in a 7-coordinate geometry to six equivalent Co and five equivalent Ga atoms. There are a spread of Sm–Co bond distances ranging from 2.92–3.35 Å. There are a spread of Sm–Ga bond distances ranging from 2.88–2.99 Å. Co is bonded in a 10-coordinate geometry to six equivalent Sm, two equivalent Co, and two equivalent Ga atoms. Both Co–Co bond lengths are 2.88 Å. There are one shorter (2.43 Å) and one longer (2.44 Å) Co–Ga bond lengths. Ga is bonded to five equivalent Sm and two equivalent Co atoms to form a mixture of distorted edge and corner-sharing GaSm5Co2 pentagonal bipyramids.

36 MATERIALS SCIENCE↗

Materials Data on SmGaCo by Materials Project

SmCoGa crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Sm is bonded in a 11-coordinate geometry to five equivalent Co and six equivalent Ga atoms. There are a spread of Sm–Co bond distances ranging from 2.90–3.06 Å. There are a spread of Sm–Ga bond distances ranging from 3.07–3.24 Å. Co is bonded in a 9-coordinate geometry to five equivalent Sm, one Co, and three equivalent Ga atoms. The Co–Co bond length is 2.34 Å. There are two shorter (2.52 Å) and one longer (2.60 Å) Co–Ga bond lengths. Ga is bonded in a 10-coordinate geometry to six equivalent Sm, three equivalent Co, and one Ga atom. The Ga–Ga bond length is 3.06 Å.

36 MATERIALS SCIENCE↗