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All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on Sm(Sn3Ru2)2 by Materials Project

Sm(Ru2Sn3)2 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Sm is bonded in a 12-coordinate geometry to four equivalent Ru and twelve Sn atoms. All Sm–Ru bond lengths are 3.30 Å. There are a spread of Sm–Sn bond distances ranging from 3.39–3.77 Å. Ru is bonded in a 7-coordinate geometry to one Sm, two equivalent Ru, and six Sn atoms. Both Ru–Ru bond lengths are 2.85 Å. There are a spread of Ru–Sn bond distances ranging from 2.60–2.80 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 6-coordinate geometry to two equivalent Sm and four equivalent Ru atoms. In the second Sn site, Sn is bonded in a 5-coordinate geometry to two equivalent Sm and four equivalent Ru atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ce(Sn3Ru2)2 by Materials Project

CeRu4Sn6 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to four equivalent Ru and twelve Sn atoms. All Ce–Ru bond lengths are 3.27 Å. There are a spread of Ce–Sn bond distances ranging from 3.38–3.78 Å. Ru is bonded in a 7-coordinate geometry to one Ce and six Sn atoms. There are a spread of Ru–Sn bond distances ranging from 2.61–2.78 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 6-coordinate geometry to two equivalent Ce and four equivalent Ru atoms. In the second Sn site, Sn is bonded in a 5-coordinate geometry to two equivalent Ce and four equivalent Ru atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Gd(Sn3Ru2)2 by Materials Project

Gd(Ru2Sn3)2 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Gd is bonded in a 12-coordinate geometry to four equivalent Ru and twelve Sn atoms. All Gd–Ru bond lengths are 3.29 Å. There are a spread of Gd–Sn bond distances ranging from 3.38–3.78 Å. Ru is bonded in a 7-coordinate geometry to one Gd and six Sn atoms. There are a spread of Ru–Sn bond distances ranging from 2.60–2.81 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 6-coordinate geometry to two equivalent Gd and four equivalent Ru atoms. In the second Sn site, Sn is bonded in a 5-coordinate geometry to two equivalent Gd and four equivalent Ru atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y(Sn3Ru2)2 by Materials Project

YRu4Sn6 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Y is bonded in a 12-coordinate geometry to four equivalent Ru and twelve Sn atoms. All Y–Ru bond lengths are 3.29 Å. There are a spread of Y–Sn bond distances ranging from 3.38–3.77 Å. Ru is bonded in a 7-coordinate geometry to one Y, two equivalent Ru, and six Sn atoms. Both Ru–Ru bond lengths are 2.84 Å. There are a spread of Ru–Sn bond distances ranging from 2.60–2.81 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 5-coordinate geometry to two equivalent Y and four equivalent Ru atoms. In the second Sn site, Sn is bonded in a 6-coordinate geometry to two equivalent Y and four equivalent Ru atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Sn3Ru2 by Materials Project

Ru2Sn3 crystallizes in the tetragonal P-4c2 space group. The structure is three-dimensional. there are three inequivalent Ru sites. In the first Ru site, Ru is bonded in a 6-coordinate geometry to six Sn atoms. There are a spread of Ru–Sn bond distances ranging from 2.62–2.80 Å. In the second Ru site, Ru is bonded in a 8-coordinate geometry to eight Sn atoms. There are four shorter (2.69 Å) and four longer (2.96 Å) Ru–Sn bond lengths. In the third Ru site, Ru is bonded in a 6-coordinate geometry to six Sn atoms. There are four shorter (2.60 Å) and two longer (2.84 Å) Ru–Sn bond lengths. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 4-coordinate geometry to four Ru atoms. In the second Sn site, Sn is bonded in a 5-coordinate geometry to five Ru atoms.

36 MATERIALS SCIENCE↗