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6 records
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on YIn3 by Materials Project

YIn3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Y is bonded to twelve equivalent In atoms to form YIn12 cuboctahedra that share corners with twelve equivalent YIn12 cuboctahedra, edges with twenty-four equivalent InY4In8 cuboctahedra, faces with six equivalent YIn12 cuboctahedra, and faces with twelve equivalent InY4In8 cuboctahedra. All Y–In bond lengths are 3.29 Å. In is bonded to four equivalent Y and eight equivalent In atoms to form distorted InY4In8 cuboctahedra that share corners with twelve equivalent InY4In8 cuboctahedra, edges with eight equivalent YIn12 cuboctahedra, edges with sixteen equivalent InY4In8 cuboctahedra, faces with four equivalent YIn12 cuboctahedra, and faces with fourteen equivalent InY4In8 cuboctahedra. All In–In bond lengths are 3.29 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y2In by Materials Project

Y2In crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 6-coordinate geometry to eight Y and six equivalent In atoms. There are two shorter (3.39 Å) and six longer (3.55 Å) Y–Y bond lengths. All Y–In bond lengths are 3.55 Å. In the second Y site, Y is bonded to six equivalent Y and five equivalent In atoms to form a mixture of distorted corner and face-sharing YY6In5 trigonal bipyramids. There are three shorter (3.12 Å) and two longer (3.39 Å) Y–In bond lengths. In is bonded in a 11-coordinate geometry to eleven Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YIn by Materials Project

YIn is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Y is bonded in a body-centered cubic geometry to eight equivalent In atoms. All Y–In bond lengths are 3.27 Å. In is bonded in a body-centered cubic geometry to eight equivalent Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y3In5 by Materials Project

Y3In5 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 9-coordinate geometry to nine In atoms. There are a spread of Y–In bond distances ranging from 3.11–3.43 Å. In the second Y site, Y is bonded in a 10-coordinate geometry to ten In atoms. There are a spread of Y–In bond distances ranging from 3.20–3.54 Å. There are three inequivalent In sites. In the first In site, In is bonded in a 5-coordinate geometry to five Y and six In atoms. There are a spread of In–In bond distances ranging from 3.17–3.30 Å. In the second In site, In is bonded in a 10-coordinate geometry to six Y and four In atoms. There are two shorter (3.04 Å) and one longer (3.25 Å) In–In bond lengths. In the third In site, In is bonded in a 10-coordinate geometry to six Y and four In atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y3In by Materials Project

Y3In is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Y is bonded to eight equivalent Y and four equivalent In atoms to form distorted YY8In4 cuboctahedra that share corners with four equivalent InY12 cuboctahedra, corners with fourteen equivalent YY8In4 cuboctahedra, edges with six equivalent InY12 cuboctahedra, edges with twelve equivalent YY8In4 cuboctahedra, faces with four equivalent InY12 cuboctahedra, and faces with sixteen equivalent YY8In4 cuboctahedra. There are a spread of Y–Y bond distances ranging from 3.36–3.54 Å. There are two shorter (3.43 Å) and two longer (3.45 Å) Y–In bond lengths. In is bonded to twelve equivalent Y atoms to form InY12 cuboctahedra that share corners with six equivalent InY12 cuboctahedra, corners with twelve equivalent YY8In4 cuboctahedra, edges with eighteen equivalent YY8In4 cuboctahedra, faces with eight equivalent InY12 cuboctahedra, and faces with twelve equivalent YY8In4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y3In5 by Materials Project

Y3In5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 9-coordinate geometry to nine In atoms. There are a spread of Y–In bond distances ranging from 3.21–3.69 Å. In the second Y site, Y is bonded in a 10-coordinate geometry to ten In atoms. There are a spread of Y–In bond distances ranging from 3.30–3.69 Å. There are four inequivalent In sites. In the first In site, In is bonded in a 3-coordinate geometry to six Y and two equivalent In atoms. Both In–In bond lengths are 3.11 Å. In the second In site, In is bonded in a 5-coordinate geometry to five Y and three In atoms. There are one shorter (3.27 Å) and two longer (3.35 Å) In–In bond lengths. In the third In site, In is bonded in a 9-coordinate geometry to six Y and three In atoms. Both In–In bond lengths are 3.18 Å. In the fourth In site, In is bonded in a 10-coordinate geometry to six Y and four In atoms. The In–In bond length is 3.14 Å.

36 MATERIALS SCIENCE↗