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At least 775 records · Page 43
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DOE OSTI2020

Materials Data on GdMgRh2 by Materials Project

MgGdRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Mg–Rh bond lengths are 2.86 Å. Gd is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Gd–Rh bond lengths are 2.86 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdCdAu2 by Materials Project

GdAu2Cd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Gd is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Gd–Au bond lengths are 3.05 Å. Au is bonded in a body-centered cubic geometry to four equivalent Gd and four equivalent Cd atoms. All Au–Cd bond lengths are 3.05 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Au atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiGdAu2 by Materials Project

LiGdAu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Li–Au bond lengths are 2.99 Å. Gd is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Gd–Au bond lengths are 2.99 Å. Au is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CaGdHg2 by Materials Project

CaGdHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Ca–Hg bond lengths are 3.25 Å. Gd is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Gd–Hg bond lengths are 3.25 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiGdHg2 by Materials Project

LiGdHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Li–Hg bond lengths are 3.12 Å. Gd is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Gd–Hg bond lengths are 3.12 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on RbGdO3 by Materials Project

RbGdO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent GdO6 octahedra. All Rb–O bond lengths are 3.16 Å. Gd is bonded to six equivalent O atoms to form GdO6 octahedra that share corners with six equivalent GdO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Gd–O bond lengths are 2.24 Å. O is bonded in a distorted linear geometry to four equivalent Rb and two equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdEr3 by Materials Project

Er3Gd is Magnesium-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Er is bonded to eight equivalent Er and four equivalent Gd atoms to form ErGd4Er8 cuboctahedra that share corners with four equivalent GdEr12 cuboctahedra, corners with fourteen equivalent ErGd4Er8 cuboctahedra, edges with six equivalent GdEr12 cuboctahedra, edges with twelve equivalent ErGd4Er8 cuboctahedra, faces with four equivalent GdEr12 cuboctahedra, and faces with sixteen equivalent ErGd4Er8 cuboctahedra. There are a spread of Er–Er bond distances ranging from 3.50–3.60 Å. There are two shorter (3.51 Å) and two longer (3.58 Å) Er–Gd bond lengths. Gd is bonded to twelve equivalent Er atoms to form GdEr12 cuboctahedra that share corners with six equivalent GdEr12 cuboctahedra, corners with twelve equivalent ErGd4Er8 cuboctahedra, edges with eighteen equivalent ErGd4Er8 cuboctahedra, faces with eight equivalent GdEr12 cuboctahedra, and faces with twelve equivalent ErGd4Er8 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdB12 by Materials Project

GdB12 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Gd is bonded in a 1-coordinate geometry to twenty-four equivalent B atoms. All Gd–B bond lengths are 2.79 Å. B is bonded in a 7-coordinate geometry to two equivalent Gd and five equivalent B atoms. There is one shorter (1.73 Å) and four longer (1.79 Å) B–B bond length.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Gd3InS6 by Materials Project

Gd3InS6 crystallizes in the orthorhombic P2_12_12 space group. The structure is three-dimensional. there are three inequivalent Gd3+ sites. In the first Gd3+ site, Gd3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Gd–S bond distances ranging from 2.84–2.95 Å. In the second Gd3+ site, Gd3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Gd–S bond distances ranging from 2.80–3.08 Å. In the third Gd3+ site, Gd3+ is bonded to seven S2- atoms to form distorted GdS7 pentagonal bipyramids that share edges with two equivalent InS6 octahedra and edges with two equivalent GdS7 pentagonal bipyramids. There are a spread of Gd–S bond distances ranging from 2.78–2.94 Å. There are two inequivalent In3+ sites. In the first In3+ site, In3+ is bonded to six S2- atoms to form InS6 octahedra that share edges with two equivalent InS6 octahedra and edges with four equivalent GdS7 pentagonal bipyramids. There are two shorter (2.63 Å) and four longer (2.65 Å) In–S bond lengths. In the second In3+ site, In3+ is bonded in a 6-coordinate geometry to six S2- atoms. There are a spread of In–S bond distances ranging from 2.47–3.21 Å. There are six inequivalent S2- sites. In the first S2- site, S2- is bonded in a 5-coordinate geometry to five Gd3+ atoms. In the second S2- site, S2- is bonded to three Gd3+ and two equivalent In3+ atoms to form distorted SGd3In2 trigonal bipyramids that share corners with four equivalent SGd3In2 trigonal bipyramids, corners with three equivalent SGd3In trigonal pyramids, edges with four equivalent SGd4In square pyramids, and an edgeedge with one SGd3In2 trigonal bipyramid. In the third S2- site, S2- is bonded in a 5-coordinate geometry to three Gd3+ and two equivalent In3+ atoms. In the fourth S2- site, S2- is bonded to four Gd3+ and one In3+ atom to form distorted SGd4In square pyramids that share a cornercorner with one SGd4In square pyramid, corners with two equivalent SGd3In trigonal pyramids, edges with two equivalent SGd4In square pyramids, and edges with four equivalent SGd3In2 trigonal bipyramids. In the fifth S2- site, S2- is bonded to three Gd3+ and one In3+ atom to form distorted SGd3In trigonal pyramids that share corners with two equivalent SGd4In square pyramids, corners with three equivalent SGd3In2 trigonal bipyramids, and corners with three equivalent SGd3In trigonal pyramids. In the sixth S2- site, S2- is bonded in a 5-coordinate geometry to five Gd3+ atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NaGdTl2 by Materials Project

NaGdTl2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Na–Tl bond lengths are 3.34 Å. Gd is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Gd–Tl bond lengths are 3.34 Å. Tl is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SmGdIn2 by Materials Project

GdSmIn2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Gd is bonded in a body-centered cubic geometry to eight equivalent In atoms. All Gd–In bond lengths are 3.31 Å. Sm is bonded in a body-centered cubic geometry to eight equivalent In atoms. All Sm–In bond lengths are 3.31 Å. In is bonded in a body-centered cubic geometry to four equivalent Gd and four equivalent Sm atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PmGdHg2 by Materials Project

GdPmHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Gd is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Gd–Hg bond lengths are 3.29 Å. Pm is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Pm–Hg bond lengths are 3.29 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Gd and four equivalent Pm atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdYHg2 by Materials Project

GdYHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Gd is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Gd–Hg bond lengths are 3.24 Å. Y is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Y–Hg bond lengths are 3.24 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Gd and four equivalent Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdLuRu2 by Materials Project

LuGdRu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Lu is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Lu–Ru bond lengths are 2.93 Å. Gd is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Gd–Ru bond lengths are 2.93 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Lu and four equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Gd2AlNi2 by Materials Project

AlGd2Ni2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Gd is bonded in a 10-coordinate geometry to six equivalent Ni atoms. There are a spread of Gd–Ni bond distances ranging from 2.89–3.00 Å. Ni is bonded in a 9-coordinate geometry to six equivalent Gd, one Ni, and two equivalent Al atoms. The Ni–Ni bond length is 2.52 Å. There are one shorter (2.55 Å) and one longer (2.56 Å) Ni–Al bond lengths. Al is bonded to four equivalent Ni atoms to form distorted edge-sharing AlNi4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NdGdIr2 by Materials Project

GdNdIr2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Gd is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. All Gd–Ir bond lengths are 3.04 Å. Nd is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. All Nd–Ir bond lengths are 3.04 Å. Ir is bonded in a body-centered cubic geometry to four equivalent Gd and four equivalent Nd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiGdTl2 by Materials Project

LiGdTl2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Li–Tl bond lengths are 3.19 Å. Gd is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Gd–Tl bond lengths are 3.19 Å. Tl is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li3Gd by Materials Project

Li3Gd crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Li is bonded in a 10-coordinate geometry to six equivalent Li and four equivalent Gd atoms. There are two shorter (2.88 Å) and four longer (3.02 Å) Li–Li bond lengths. There are two shorter (3.22 Å) and two longer (3.24 Å) Li–Gd bond lengths. Gd is bonded to twelve equivalent Li atoms to form a mixture of corner and face-sharing GdLi12 cuboctahedra.

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