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At least 937 records · Page 52
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DOE OSTI2020

Materials Data on HfSiRh by Materials Project

HfRhSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Hf is bonded in a 11-coordinate geometry to six equivalent Rh and five equivalent Si atoms. There are a spread of Hf–Rh bond distances ranging from 2.93–3.04 Å. There are three shorter (2.79 Å) and two longer (2.80 Å) Hf–Si bond lengths. Rh is bonded in a 4-coordinate geometry to six equivalent Hf and four equivalent Si atoms. There are a spread of Rh–Si bond distances ranging from 2.44–2.50 Å. Si is bonded in a 9-coordinate geometry to five equivalent Hf and four equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Er(BRh)4 by Materials Project

ErRh4B4 crystallizes in the tetragonal I4_1/acd space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to twelve equivalent Rh and twelve equivalent B atoms. There are a spread of Er–Rh bond distances ranging from 2.91–3.26 Å. There are a spread of Er–B bond distances ranging from 2.96–3.26 Å. Rh is bonded in a 5-coordinate geometry to three equivalent Er and five equivalent B atoms. There are a spread of Rh–B bond distances ranging from 2.18–2.27 Å. B is bonded in a 6-coordinate geometry to three equivalent Er, five equivalent Rh, and one B atom. The B–B bond length is 1.75 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on DyRh3C by Materials Project

DyRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Dy is bonded to twelve equivalent Rh atoms to form DyRh12 cuboctahedra that share corners with twelve equivalent DyRh12 cuboctahedra, faces with six equivalent DyRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Dy–Rh bond lengths are 2.96 Å. Rh is bonded to four equivalent Dy and two equivalent C atoms to form a mixture of distorted face, edge, and corner-sharing RhDy4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.09 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent DyRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NdRh3C by Materials Project

NdRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Nd is bonded to twelve equivalent Rh atoms to form NdRh12 cuboctahedra that share corners with twelve equivalent NdRh12 cuboctahedra, faces with six equivalent NdRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Nd–Rh bond lengths are 3.00 Å. Rh is bonded to four equivalent Nd and two equivalent C atoms to form a mixture of distorted edge, face, and corner-sharing RhNd4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.12 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent NdRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Np(GeRh)2 by Materials Project

Np(RhGe)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Np is bonded in a 8-coordinate geometry to eight equivalent Rh and eight equivalent Ge atoms. All Np–Rh bond lengths are 3.35 Å. All Np–Ge bond lengths are 3.18 Å. Rh is bonded to four equivalent Np and four equivalent Ge atoms to form a mixture of distorted edge, corner, and face-sharing RhNp4Ge4 tetrahedra. All Rh–Ge bond lengths are 2.47 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Np, four equivalent Rh, and one Ge atom. The Ge–Ge bond length is 2.56 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PrMgRh by Materials Project

MgPrRh crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Mg is bonded to four equivalent Rh atoms to form a mixture of distorted edge and corner-sharing MgRh4 tetrahedra. There are a spread of Mg–Rh bond distances ranging from 2.78–2.90 Å. Pr is bonded in a 5-coordinate geometry to five equivalent Rh atoms. There are a spread of Pr–Rh bond distances ranging from 3.03–3.11 Å. Rh is bonded in a 9-coordinate geometry to four equivalent Mg and five equivalent Pr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiSn4Rh by Materials Project

LiRhSn4 is Khatyrkite-derived structured and crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Li is bonded in a q6 geometry to two equivalent Rh and eight equivalent Sn atoms. Both Li–Rh bond lengths are 2.88 Å. All Li–Sn bond lengths are 2.97 Å. Rh is bonded in a distorted q6 geometry to two equivalent Li and eight equivalent Sn atoms. All Rh–Sn bond lengths are 2.84 Å. Sn is bonded in a 4-coordinate geometry to two equivalent Li and two equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ho2Si3Rh by Materials Project

Ho2RhSi3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded to twelve equivalent Si atoms to form HoSi12 cuboctahedra that share edges with twelve equivalent HoSi8Rh4 cuboctahedra and faces with eight HoSi12 cuboctahedra. All Ho–Si bond lengths are 3.07 Å. In the second Ho site, Ho is bonded to four equivalent Rh and eight equivalent Si atoms to form a mixture of distorted face and edge-sharing HoSi8Rh4 cuboctahedra. There are two shorter (3.01 Å) and two longer (3.15 Å) Ho–Rh bond lengths. There are four shorter (3.02 Å) and four longer (3.11 Å) Ho–Si bond lengths. Rh is bonded in a 3-coordinate geometry to six equivalent Ho and three equivalent Si atoms. All Rh–Si bond lengths are 2.37 Å. Si is bonded in a 1-coordinate geometry to six Ho, one Rh, and two equivalent Si atoms. Both Si–Si bond lengths are 2.36 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YSiRh by Materials Project

YRhSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Y is bonded in a 11-coordinate geometry to six equivalent Rh and five equivalent Si atoms. There are a spread of Y–Rh bond distances ranging from 2.98–3.32 Å. There are a spread of Y–Si bond distances ranging from 2.98–3.03 Å. Rh is bonded in a 10-coordinate geometry to six equivalent Y and four equivalent Si atoms. There are a spread of Rh–Si bond distances ranging from 2.48–2.63 Å. Si is bonded in a 9-coordinate geometry to five equivalent Y and four equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NiAsRh by Materials Project

RhNiAs is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Rh is bonded in a 1-coordinate geometry to four equivalent Ni and five equivalent As atoms. All Rh–Ni bond lengths are 2.88 Å. There are one shorter (2.40 Å) and four longer (2.65 Å) Rh–As bond lengths. Ni is bonded to four equivalent Rh, four equivalent Ni, and four equivalent As atoms to form a mixture of distorted corner and face-sharing NiNi4As4Rh4 cuboctahedra. All Ni–Ni bond lengths are 2.56 Å. All Ni–As bond lengths are 2.39 Å. As is bonded in a 9-coordinate geometry to five equivalent Rh and four equivalent Ni atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdBRh3 by Materials Project

GdRh3B is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Gd is bonded to twelve equivalent Rh atoms to form GdRh12 cuboctahedra that share corners with twelve equivalent GdRh12 cuboctahedra, faces with six equivalent GdRh12 cuboctahedra, and faces with eight equivalent BRh6 octahedra. All Gd–Rh bond lengths are 2.99 Å. Rh is bonded to four equivalent Gd and two equivalent B atoms to form a mixture of distorted face, edge, and corner-sharing RhGd4B2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–B bond lengths are 2.11 Å. B is bonded to six equivalent Rh atoms to form BRh6 octahedra that share corners with six equivalent BRh6 octahedra and faces with eight equivalent GdRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ErGeRh by Materials Project

ErRhGe crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Er is bonded in a 11-coordinate geometry to six equivalent Rh and five equivalent Ge atoms. There are a spread of Er–Rh bond distances ranging from 3.00–3.33 Å. There are three shorter (3.00 Å) and two longer (3.01 Å) Er–Ge bond lengths. Rh is bonded in a 10-coordinate geometry to six equivalent Er and four equivalent Ge atoms. There are a spread of Rh–Ge bond distances ranging from 2.55–2.62 Å. Ge is bonded in a 9-coordinate geometry to five equivalent Er and four equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdRh3C by Materials Project

GdRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Gd is bonded to twelve equivalent Rh atoms to form GdRh12 cuboctahedra that share corners with twelve equivalent GdRh12 cuboctahedra, faces with six equivalent GdRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Gd–Rh bond lengths are 2.98 Å. Rh is bonded to four equivalent Gd and two equivalent C atoms to form a mixture of distorted edge, face, and corner-sharing RhGd4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.10 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent GdRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on USiRh by Materials Project

URhSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. U is bonded in a 7-coordinate geometry to two equivalent U, six equivalent Rh, and five equivalent Si atoms. Both U–U bond lengths are 2.69 Å. There are a spread of U–Rh bond distances ranging from 3.02–3.39 Å. There are a spread of U–Si bond distances ranging from 2.88–2.97 Å. Rh is bonded in a 4-coordinate geometry to six equivalent U and four equivalent Si atoms. There are a spread of Rh–Si bond distances ranging from 2.42–2.51 Å. Si is bonded in a 9-coordinate geometry to five equivalent U and four equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CaInRh by Materials Project

CaRhIn crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ca is bonded in a 5-coordinate geometry to five equivalent Rh and six equivalent In atoms. There are a spread of Ca–Rh bond distances ranging from 3.11–3.14 Å. There are a spread of Ca–In bond distances ranging from 3.33–3.42 Å. Rh is bonded in a 9-coordinate geometry to five equivalent Ca and four equivalent In atoms. There are a spread of Rh–In bond distances ranging from 2.75–2.79 Å. In is bonded in a 4-coordinate geometry to six equivalent Ca and four equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Np(SiRh)2 by Materials Project

Np(RhSi)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Np is bonded in a 8-coordinate geometry to eight equivalent Rh and eight equivalent Si atoms. All Np–Rh bond lengths are 3.22 Å. All Np–Si bond lengths are 3.05 Å. Rh is bonded to four equivalent Np and four equivalent Si atoms to form a mixture of distorted edge, corner, and face-sharing RhNp4Si4 tetrahedra. All Rh–Si bond lengths are 2.41 Å. Si is bonded in a 9-coordinate geometry to four equivalent Np, four equivalent Rh, and one Si atom. The Si–Si bond length is 2.34 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on UGeRh by Materials Project

URhGe crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. U is bonded in a 1-coordinate geometry to six equivalent Rh and six equivalent Ge atoms. There are a spread of U–Rh bond distances ranging from 2.81–3.23 Å. There are a spread of U–Ge bond distances ranging from 3.04–3.12 Å. Rh is bonded in a 10-coordinate geometry to six equivalent U and four equivalent Ge atoms. There are a spread of Rh–Ge bond distances ranging from 2.60–2.70 Å. Ge is bonded in a 10-coordinate geometry to six equivalent U and four equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TaSiRh by Materials Project

TaRhSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ta is bonded in a 11-coordinate geometry to six equivalent Rh and five equivalent Si atoms. There are a spread of Ta–Rh bond distances ranging from 2.91–3.00 Å. There are three shorter (2.68 Å) and two longer (2.74 Å) Ta–Si bond lengths. Rh is bonded in a 4-coordinate geometry to six equivalent Ta and four equivalent Si atoms. There are a spread of Rh–Si bond distances ranging from 2.41–2.47 Å. Si is bonded in a 9-coordinate geometry to five equivalent Ta and four equivalent Rh atoms.

36 MATERIALS SCIENCE↗