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All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on YbIn2Ni by Materials Project

YbNiIn2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb is bonded in a 1-coordinate geometry to three equivalent Ni and ten equivalent In atoms. There are one shorter (2.84 Å) and two longer (3.12 Å) Yb–Ni bond lengths. There are six shorter (3.31 Å) and four longer (3.41 Å) Yb–In bond lengths. Ni is bonded in a 9-coordinate geometry to three equivalent Yb and six equivalent In atoms. There are two shorter (2.69 Å) and four longer (2.75 Å) Ni–In bond lengths. In is bonded in a 12-coordinate geometry to five equivalent Yb, three equivalent Ni, and four equivalent In atoms. There are a spread of In–In bond distances ranging from 3.05–3.12 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbIn4Ni by Materials Project

YbNiIn4 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a 11-coordinate geometry to two equivalent Ni and thirteen In atoms. There are one shorter (3.25 Å) and one longer (3.29 Å) Yb–Ni bond lengths. There are a spread of Yb–In bond distances ranging from 3.25–3.83 Å. In the second Yb site, Yb is bonded in a 7-coordinate geometry to two equivalent Ni and thirteen In atoms. Both Yb–Ni bond lengths are 3.25 Å. There are a spread of Yb–In bond distances ranging from 3.26–3.86 Å. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to two equivalent Yb and seven In atoms. There are a spread of Ni–In bond distances ranging from 2.62–2.76 Å. In the second Ni site, Ni is bonded in a 9-coordinate geometry to two equivalent Yb and seven In atoms. There are a spread of Ni–In bond distances ranging from 2.62–2.77 Å. There are eight inequivalent In sites. In the first In site, In is bonded in a 2-coordinate geometry to three Yb, one Ni, and four In atoms. There are a spread of In–In bond distances ranging from 3.09–3.15 Å. In the second In site, In is bonded in a 12-coordinate geometry to three Yb, three Ni, and one In atom. The In–In bond length is 3.12 Å. In the third In site, In is bonded in a 2-coordinate geometry to three Yb, one Ni, and four In atoms. There are a spread of In–In bond distances ranging from 3.09–3.12 Å. In the fourth In site, In is bonded in a 12-coordinate geometry to three Yb, three Ni, and one In atom. The In–In bond length is 3.15 Å. In the fifth In site, In is bonded in a 12-coordinate geometry to three Yb, three Ni, and one In atom. The In–In bond length is 3.13 Å. In the sixth In site, In is bonded in a distorted q6 geometry to four Yb and six In atoms. The In–In bond length is 3.11 Å. In the seventh In site, In is bonded in a distorted q6 geometry to four Yb and six In atoms. In the eighth In site, In is bonded in a 12-coordinate geometry to three Yb, three Ni, and one In atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbInNi4 by Materials Project

YbInNi4 crystallizes in the cubic F-43m space group. The structure is three-dimensional. Yb is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent In atoms. All Yb–Ni bond lengths are 2.89 Å. All Yb–In bond lengths are 3.02 Å. Ni is bonded to three equivalent Yb, six equivalent Ni, and three equivalent In atoms to form a mixture of face, edge, and corner-sharing NiYb3In3Ni6 cuboctahedra. There are three shorter (2.46 Å) and three longer (2.47 Å) Ni–Ni bond lengths. All Ni–In bond lengths are 2.89 Å. In is bonded in a 4-coordinate geometry to four equivalent Yb and twelve equivalent Ni atoms.

36 MATERIALS SCIENCE↗