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6 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on YbSn2Pd by Materials Project

YbPdSn2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb is bonded in a 1-coordinate geometry to three equivalent Pd and ten equivalent Sn atoms. There are one shorter (3.04 Å) and two longer (3.35 Å) Yb–Pd bond lengths. There are a spread of Yb–Sn bond distances ranging from 3.23–3.59 Å. Pd is bonded in a 9-coordinate geometry to three equivalent Yb and six equivalent Sn atoms. There are four shorter (2.80 Å) and two longer (2.83 Å) Pd–Sn bond lengths. Sn is bonded in a 5-coordinate geometry to five equivalent Yb and three equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbSnPd by Materials Project

YbPdSn crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Yb is bonded in a 11-coordinate geometry to five equivalent Pd and six equivalent Sn atoms. There are a spread of Yb–Pd bond distances ranging from 3.05–3.20 Å. There are one shorter (3.27 Å) and five longer (3.36 Å) Yb–Sn bond lengths. Pd is bonded in a 9-coordinate geometry to five equivalent Yb and four equivalent Sn atoms. There are a spread of Pd–Sn bond distances ranging from 2.72–2.81 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Yb and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbSnPd2 by Materials Project

YbPd2Sn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Yb is bonded in a body-centered cubic geometry to eight equivalent Pd and six equivalent Sn atoms. All Yb–Pd bond lengths are 2.91 Å. All Yb–Sn bond lengths are 3.37 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Sn atoms. All Pd–Sn bond lengths are 2.91 Å. Sn is bonded in a distorted body-centered cubic geometry to six equivalent Yb and eight equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbSnPd by Materials Project

YbPdSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Yb is bonded in a 11-coordinate geometry to five Pd and six equivalent Sn atoms. There are four shorter (3.03 Å) and one longer (3.13 Å) Yb–Pd bond lengths. There are two shorter (3.18 Å) and four longer (3.34 Å) Yb–Sn bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 9-coordinate geometry to six equivalent Yb and three equivalent Sn atoms. All Pd–Sn bond lengths are 2.88 Å. In the second Pd site, Pd is bonded in a 9-coordinate geometry to three equivalent Yb and six equivalent Sn atoms. All Pd–Sn bond lengths are 2.82 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Yb and four Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Yb2SnPd2 by Materials Project

Yb2Pd2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Yb is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent Sn atoms. There are two shorter (2.85 Å) and four longer (2.98 Å) Yb–Pd bond lengths. All Yb–Sn bond lengths are 3.40 Å. Pd is bonded in a 6-coordinate geometry to six equivalent Yb, one Pd, and two equivalent Sn atoms. The Pd–Pd bond length is 2.90 Å. Both Pd–Sn bond lengths are 2.95 Å. Sn is bonded to eight equivalent Yb and four equivalent Pd atoms to form a mixture of corner and face-sharing SnYb8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Yb2Sn5Pd3 by Materials Project

Yb2Pd3Sn5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a 1-coordinate geometry to five Pd and eight Sn atoms. There are a spread of Yb–Pd bond distances ranging from 2.92–3.38 Å. There are a spread of Yb–Sn bond distances ranging from 3.20–3.44 Å. In the second Yb site, Yb is bonded in a 8-coordinate geometry to two equivalent Pd and six Sn atoms. Both Yb–Pd bond lengths are 3.29 Å. There are four shorter (3.24 Å) and two longer (3.27 Å) Yb–Sn bond lengths. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded in a 9-coordinate geometry to three Yb and six Sn atoms. There are a spread of Pd–Sn bond distances ranging from 2.74–2.94 Å. In the second Pd site, Pd is bonded in a 9-coordinate geometry to four equivalent Yb and five Sn atoms. There are a spread of Pd–Sn bond distances ranging from 2.69–2.83 Å. In the third Pd site, Pd is bonded in a 7-coordinate geometry to seven Sn atoms. There are a spread of Pd–Sn bond distances ranging from 2.76–2.91 Å. There are five inequivalent Sn sites. In the first Sn site, Sn is bonded in a 6-coordinate geometry to two equivalent Yb and four Pd atoms. In the second Sn site, Sn is bonded in a 5-coordinate geometry to two equivalent Yb, three equivalent Pd, and one Sn atom. The Sn–Sn bond length is 3.10 Å. In the third Sn site, Sn is bonded in a 12-coordinate geometry to four equivalent Yb and four Pd atoms. In the fourth Sn site, Sn is bonded in a 4-coordinate geometry to two equivalent Yb and four Pd atoms. In the fifth Sn site, Sn is bonded in a 3-coordinate geometry to four Yb, three Pd, and one Sn atom.

36 MATERIALS SCIENCE↗