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At least 1,171 records · Page 65

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DOE OSTI2020

Materials Data on NaCd2Rh by Materials Project

NaRhCd2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a distorted body-centered cubic geometry to six equivalent Rh and eight equivalent Cd atoms. All Na–Rh bond lengths are 3.37 Å. All Na–Cd bond lengths are 2.92 Å. Rh is bonded in a distorted body-centered cubic geometry to six equivalent Na and eight equivalent Cd atoms. All Rh–Cd bond lengths are 2.92 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Rh atoms.

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DOE OSTI2020

Materials Data on CdAg3 by Materials Project

Ag3Cd is beta Cu3Ti-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Ag sites. In the first Ag site, Ag is bonded to eight Ag and four equivalent Cd atoms to form AgCd4Ag8 cuboctahedra that share corners with twelve equivalent AgCd4Ag8 cuboctahedra, edges with eight equivalent CdAg12 cuboctahedra, edges with sixteen AgCd4Ag8 cuboctahedra, faces with four equivalent CdAg12 cuboctahedra, and faces with fourteen AgCd4Ag8 cuboctahedra. There are four shorter (2.96 Å) and four longer (2.99 Å) Ag–Ag bond lengths. All Ag–Cd bond lengths are 2.99 Å. In the second Ag site, Ag is bonded to eight equivalent Ag and four equivalent Cd atoms to form AgCd4Ag8 cuboctahedra that share corners with four equivalent AgCd4Ag8 cuboctahedra, corners with eight equivalent CdAg12 cuboctahedra, edges with twenty-four AgCd4Ag8 cuboctahedra, faces with six equivalent CdAg12 cuboctahedra, and faces with twelve AgCd4Ag8 cuboctahedra. All Ag–Cd bond lengths are 2.96 Å. Cd is bonded to twelve Ag atoms to form CdAg12 cuboctahedra that share corners with four equivalent CdAg12 cuboctahedra, corners with eight equivalent AgCd4Ag8 cuboctahedra, edges with eight equivalent CdAg12 cuboctahedra, edges with sixteen equivalent AgCd4Ag8 cuboctahedra, faces with four equivalent CdAg12 cuboctahedra, and faces with fourteen AgCd4Ag8 cuboctahedra.

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DOE OSTI2020

Materials Data on Yb3Cd by Materials Project

Yb3Cd is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded to four equivalent Yb and four equivalent Cd atoms to form a mixture of distorted corner, edge, and face-sharing YbYb4Cd4 tetrahedra. All Yb–Yb bond lengths are 3.43 Å. All Yb–Cd bond lengths are 3.43 Å. In the second Yb site, Yb is bonded in a 8-coordinate geometry to eight equivalent Yb and six equivalent Cd atoms. All Yb–Cd bond lengths are 3.96 Å. Cd is bonded in a body-centered cubic geometry to fourteen Yb atoms.

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DOE OSTI2020

Materials Data on ScCd2Ag by Materials Project

ScAgCd2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two ScAgCd2 ribbons oriented in the (1, 0, 0) direction. Sc is bonded in a linear geometry to two equivalent Cd atoms. Both Sc–Cd bond lengths are 3.04 Å. Ag is bonded in a linear geometry to two equivalent Cd atoms. Both Ag–Cd bond lengths are 2.77 Å. Cd is bonded in a linear geometry to one Sc and one Ag atom.

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DOE OSTI2020

Materials Data on HoTmCd2 by Materials Project

TmHoCd2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tm is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Tm–Cd bond lengths are 3.22 Å. Ho is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Ho–Cd bond lengths are 3.22 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Tm and four equivalent Ho atoms.

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DOE OSTI2020

Materials Data on SrMgCd2 by Materials Project

SrMgCd2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two SrMgCd2 ribbons oriented in the (0, 1, 0) direction. Sr is bonded in a linear geometry to two equivalent Cd atoms. Both Sr–Cd bond lengths are 3.68 Å. Mg is bonded in a linear geometry to two equivalent Cd atoms. Both Mg–Cd bond lengths are 3.26 Å. Cd is bonded in a linear geometry to one Sr and one Mg atom.

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DOE OSTI2020

Materials Data on SrLaCd2 by Materials Project

SrLaCd2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two SrLaCd2 ribbons oriented in the (0, 1, 0) direction. Sr is bonded in a linear geometry to two equivalent Cd atoms. Both Sr–Cd bond lengths are 3.52 Å. La is bonded in a linear geometry to two equivalent Cd atoms. Both La–Cd bond lengths are 3.20 Å. Cd is bonded in a linear geometry to one Sr and one La atom.

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DOE OSTI2020

Materials Data on Nd2CdPd2 by Materials Project

Nd2Pd2Cd crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Nd is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent Cd atoms. There are two shorter (2.95 Å) and four longer (3.11 Å) Nd–Pd bond lengths. All Nd–Cd bond lengths are 3.51 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Nd, one Pd, and two equivalent Cd atoms. The Pd–Pd bond length is 2.84 Å. Both Pd–Cd bond lengths are 3.09 Å. Cd is bonded to eight equivalent Nd and four equivalent Pd atoms to form a mixture of face and corner-sharing CdNd8Pd4 cuboctahedra.

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DOE OSTI2020

Materials Data on MnCd4S5 by Materials Project

MnCd4S5 is Chalcopyrite-like structured and crystallizes in the monoclinic Cm space group. The structure is three-dimensional. Mn2+ is bonded to four S2- atoms to form MnS4 tetrahedra that share corners with two equivalent MnS4 tetrahedra and corners with ten CdS4 tetrahedra. There are a spread of Mn–S bond distances ranging from 2.43–2.46 Å. There are five inequivalent Cd2+ sites. In the first Cd2+ site, Cd2+ is bonded to four S2- atoms to form CdS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra and corners with eight CdS4 tetrahedra. There are a spread of Cd–S bond distances ranging from 2.56–2.59 Å. In the second Cd2+ site, Cd2+ is bonded to four S2- atoms to form CdS4 tetrahedra that share corners with two equivalent MnS4 tetrahedra and corners with ten CdS4 tetrahedra. There are a spread of Cd–S bond distances ranging from 2.55–2.57 Å. In the third Cd2+ site, Cd2+ is bonded to four S2- atoms to form corner-sharing CdS4 tetrahedra. There are three shorter (2.55 Å) and one longer (2.56 Å) Cd–S bond lengths. In the fourth Cd2+ site, Cd2+ is bonded to four S2- atoms to form CdS4 tetrahedra that share corners with three equivalent MnS4 tetrahedra and corners with nine CdS4 tetrahedra. There are a spread of Cd–S bond distances ranging from 2.57–2.59 Å. In the fifth Cd2+ site, Cd2+ is bonded to four S2- atoms to form CdS4 tetrahedra that share corners with two equivalent MnS4 tetrahedra and corners with ten CdS4 tetrahedra. There are two shorter (2.57 Å) and two longer (2.58 Å) Cd–S bond lengths. There are six inequivalent S2- sites. In the first S2- site, S2- is bonded to two equivalent Mn2+ and two Cd2+ atoms to form corner-sharing SMn2Cd2 tetrahedra. In the second S2- site, S2- is bonded to one Mn2+ and three Cd2+ atoms to form corner-sharing SMnCd3 tetrahedra. In the third S2- site, S2- is bonded to four Cd2+ atoms to form corner-sharing SCd4 tetrahedra. In the fourth S2- site, S2- is bonded to four Cd2+ atoms to form corner-sharing SCd4 tetrahedra. In the fifth S2- site, S2- is bonded to one Mn2+ and three Cd2+ atoms to form corner-sharing SMnCd3 tetrahedra. In the sixth S2- site, S2- is bonded to four Cd2+ atoms to form corner-sharing SCd4 tetrahedra.

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Materials Data on NaCd2In by Materials Project

NaCd2In crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two NaCd2In ribbons oriented in the (1, 0, 0) direction. Na is bonded in a linear geometry to two equivalent Cd atoms. Both Na–Cd bond lengths are 3.02 Å. Cd is bonded in a linear geometry to one Na and one In atom. The Cd–In bond length is 2.96 Å. In is bonded in a linear geometry to two equivalent Cd atoms.

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DOE OSTI2020

Materials Data on CaCdSn by Materials Project

CaCdSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ca is bonded in a 4-coordinate geometry to four equivalent Cd and six equivalent Sn atoms. All Ca–Cd bond lengths are 3.04 Å. All Ca–Sn bond lengths are 3.51 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Sn atoms. All Cd–Sn bond lengths are 3.04 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Ca and four equivalent Cd atoms.

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DOE OSTI2020

Materials Data on HoCdNi4 by Materials Project

HoNi4Cd is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ho is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent Cd atoms. All Ho–Ni bond lengths are 2.91 Å. All Ho–Cd bond lengths are 3.04 Å. Ni is bonded to three equivalent Ho, six equivalent Ni, and three equivalent Cd atoms to form a mixture of edge, face, and corner-sharing NiHo3Cd3Ni6 cuboctahedra. There are three shorter (2.46 Å) and three longer (2.50 Å) Ni–Ni bond lengths. All Ni–Cd bond lengths are 2.91 Å. Cd is bonded in a 4-coordinate geometry to four equivalent Ho and twelve equivalent Ni atoms.

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DOE OSTI2020

Materials Data on CeMgCd2 by Materials Project

MgCeCd2 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 Cd atoms. All Mg–Cd bond lengths are 3.17 Å. Ce is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Ce–Cd bond lengths are 3.17 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Ce atoms.

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DOE OSTI2020

Materials Data on Mg16Al12Cd by Materials Project

Mg16CdAl12 crystallizes in the cubic I-43m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 12-coordinate geometry to seven Mg and five equivalent Al atoms. There are a spread of Mg–Mg bond distances ranging from 3.06–3.18 Å. There are a spread of Mg–Al bond distances ranging from 2.91–3.16 Å. In the second Mg site, Mg is bonded in a 10-coordinate geometry to three equivalent Mg, one Cd, and six equivalent Al atoms. The Mg–Cd bond length is 3.10 Å. All Mg–Al bond lengths are 3.10 Å. Cd is bonded in a distorted tetrahedral geometry to four equivalent Mg and twelve equivalent Al atoms. All Cd–Al bond lengths are 3.23 Å. Al is bonded in a 11-coordinate geometry to seven Mg, one Cd, and three equivalent Al atoms. There are one shorter (2.73 Å) and two longer (2.78 Å) Al–Al bond lengths.

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DOE OSTI2020

Materials Data on CdPd2Au by Materials Project

Pd2AuCd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pd is bonded in a body-centered cubic geometry to four equivalent Au and four equivalent Cd atoms. All Pd–Au bond lengths are 2.82 Å. All Pd–Cd bond lengths are 2.82 Å. Au is bonded in a distorted body-centered cubic geometry to eight equivalent Pd and six equivalent Cd atoms. All Au–Cd bond lengths are 3.25 Å. Cd is bonded in a distorted body-centered cubic geometry to eight equivalent Pd and six equivalent Au atoms.

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DOE OSTI2020

Materials Data on U3Cd by Materials Project

U3Cd is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a distorted body-centered cubic geometry to four equivalent U and four equivalent Cd atoms. All U–U bond lengths are 3.01 Å. All U–Cd bond lengths are 3.01 Å. In the second U site, U is bonded in a 8-coordinate geometry to eight equivalent U and six equivalent Cd atoms. All U–Cd bond lengths are 3.48 Å. Cd is bonded in a distorted body-centered cubic geometry to fourteen U atoms.

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DOE OSTI2020

Materials Data on NaCd2Pd by Materials Project

NaPdCd2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a distorted body-centered cubic geometry to six equivalent Pd and eight equivalent Cd atoms. All Na–Pd bond lengths are 3.41 Å. All Na–Cd bond lengths are 2.96 Å. Pd is bonded in a distorted body-centered cubic geometry to six equivalent Na and eight equivalent Cd atoms. All Pd–Cd bond lengths are 2.96 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Pd atoms.

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DOE OSTI2020

Materials Data on LiCd2Cu by Materials Project

LiCuCd2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two LiCuCd2 ribbons oriented in the (1, 0, 0) direction. Li is bonded in a linear geometry to two equivalent Cd atoms. Both Li–Cd bond lengths are 2.81 Å. Cu is bonded in a linear geometry to two equivalent Cd atoms. Both Cu–Cd bond lengths are 2.56 Å. Cd is bonded in a linear geometry to one Li and one Cu atom.

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