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At least 1,801 records · Page 100
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DOE OSTI2020

Materials Data on Zr5CdPb3 by Materials Project

Zr5CdPb3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Zr sites. In the first Zr site, Zr is bonded in a 6-coordinate geometry to six equivalent Pb atoms. All Zr–Pb bond lengths are 3.17 Å. In the second Zr site, Zr is bonded to two equivalent Cd and five equivalent Pb atoms to form a mixture of distorted corner, edge, and face-sharing ZrCd2Pb5 pentagonal bipyramids. Both Zr–Cd bond lengths are 2.91 Å. There are three shorter (3.04 Å) and two longer (3.15 Å) Zr–Pb bond lengths. Cd is bonded to six equivalent Zr atoms to form distorted face-sharing CdZr6 octahedra. Pb is bonded in a 9-coordinate geometry to nine Zr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CaCdAg2 by Materials Project

CaAg2Cd crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two CaAg2Cd ribbons oriented in the (1, 0, 0) direction. Ca is bonded in a linear geometry to two equivalent Ag atoms. Both Ca–Ag bond lengths are 2.86 Å. Ag is bonded in a linear geometry to one Ca and one Cd atom. The Ag–Cd bond length is 2.90 Å. Cd is bonded in a linear geometry to two equivalent Ag atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li2CdIn by Materials Project

Li2CdIn crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Li2CdIn ribbons oriented in the (0, 1, 0) direction. Li is bonded in a linear geometry to one Cd and one In atom. The Li–Cd bond length is 2.90 Å. The Li–In bond length is 2.86 Å. Cd is bonded in a linear geometry to two equivalent Li atoms. In is bonded in a linear geometry to two equivalent Li atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Mg2TlCd by Materials Project

Mg2CdTl crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Mg2CdTl ribbons oriented in the (0, 1, 0) direction. Mg is bonded in a linear geometry to one Cd and one Tl atom. The Mg–Cd bond length is 3.23 Å. The Mg–Tl bond length is 3.28 Å. Cd is bonded in a linear geometry to two equivalent Mg atoms. Tl is bonded in a linear geometry to two equivalent Mg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdAg by Materials Project

AgCd crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of two AgCd sheets oriented in the (0, 1, 0) direction. Ag is bonded in a 8-coordinate geometry to four equivalent Cd atoms. All Ag–Cd bond lengths are 2.94 Å. Cd is bonded in a 8-coordinate geometry to four equivalent Ag atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdFeRh2 by Materials Project

FeRh2Cd crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two FeRh2Cd ribbons oriented in the (1, 0, 0) direction. Fe is bonded in a linear geometry to two equivalent Rh atoms. Both Fe–Rh bond lengths are 2.15 Å. Rh is bonded in a linear geometry to one Fe and one Cd atom. The Rh–Cd bond length is 2.73 Å. Cd is bonded in a linear geometry to two equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TlCdIn2 by Materials Project

CdTlIn2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two CdTlIn2 ribbons oriented in the (1, 0, 0) direction. Cd is bonded in a linear geometry to two equivalent In atoms. Both Cd–In bond lengths are 3.02 Å. Tl is bonded in a linear geometry to two equivalent In atoms. Both Tl–In bond lengths are 2.97 Å. In is bonded in a linear geometry to one Cd and one Tl atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ZnCd3GeS6 by Materials Project

Cd3ZnGeS6 is Chalcostibite-derived structured and crystallizes in the monoclinic Cc space group. The structure is three-dimensional. there are three inequivalent Cd2+ sites. In the first Cd2+ site, Cd2+ is bonded in a 5-coordinate geometry to five S2- atoms. There are a spread of Cd–S bond distances ranging from 2.59–3.26 Å. In the second Cd2+ site, Cd2+ is bonded to four S2- atoms to form CdS4 tetrahedra that share corners with two equivalent CdS4 tetrahedra, corners with two equivalent GeS4 tetrahedra, and corners with three equivalent ZnS4 tetrahedra. There are a spread of Cd–S bond distances ranging from 2.59–2.61 Å. In the third Cd2+ site, Cd2+ is bonded to four S2- atoms to form CdS4 tetrahedra that share corners with two equivalent CdS4 tetrahedra, corners with two equivalent GeS4 tetrahedra, and corners with three equivalent ZnS4 tetrahedra. There are a spread of Cd–S bond distances ranging from 2.57–2.67 Å. Zn2+ is bonded to four S2- atoms to form ZnS4 tetrahedra that share corners with two equivalent GeS4 tetrahedra and corners with six CdS4 tetrahedra. There are a spread of Zn–S bond distances ranging from 2.39–2.47 Å. Ge4+ is bonded to four S2- atoms to form GeS4 tetrahedra that share corners with two equivalent ZnS4 tetrahedra and corners with four CdS4 tetrahedra. There are a spread of Ge–S bond distances ranging from 2.20–2.24 Å. There are six inequivalent S2- sites. In the first S2- site, S2- is bonded to three Cd2+ and one Zn2+ atom to form corner-sharing SZnCd3 tetrahedra. In the second S2- site, S2- is bonded in a trigonal non-coplanar geometry to two Cd2+ and one Ge4+ atom. In the third S2- site, S2- is bonded to three Cd2+ and one Zn2+ atom to form distorted corner-sharing SZnCd3 tetrahedra. In the fourth S2- site, S2- is bonded in a 3-coordinate geometry to two Cd2+, one Zn2+, and one Ge4+ atom. In the fifth S2- site, S2- is bonded in a distorted trigonal non-coplanar geometry to two Cd2+ and one Ge4+ atom. In the sixth S2- site, S2- is bonded in a distorted trigonal non-coplanar geometry to one Cd2+, one Zn2+, and one Ge4+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on La3Cd by Materials Project

La3Cd is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. La is bonded to eight equivalent La and four equivalent Cd atoms to form distorted LaLa8Cd4 cuboctahedra that share corners with twelve equivalent LaLa8Cd4 cuboctahedra, edges with eight equivalent CdLa12 cuboctahedra, edges with sixteen equivalent LaLa8Cd4 cuboctahedra, faces with four equivalent CdLa12 cuboctahedra, and faces with fourteen equivalent LaLa8Cd4 cuboctahedra. All La–La bond lengths are 3.59 Å. All La–Cd bond lengths are 3.59 Å. Cd is bonded to twelve equivalent La atoms to form CdLa12 cuboctahedra that share corners with twelve equivalent CdLa12 cuboctahedra, edges with twenty-four equivalent LaLa8Cd4 cuboctahedra, faces with six equivalent CdLa12 cuboctahedra, and faces with twelve equivalent LaLa8Cd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ac2CdGe by Materials Project

Ac2CdGe is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ac is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Ge atoms. All Ac–Cd bond lengths are 3.45 Å. All Ac–Ge bond lengths are 3.45 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Ac atoms. Ge is bonded in a body-centered cubic geometry to eight equivalent Ac atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Mg2CdPt by Materials Project

Mg2PtCd crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Mg2PtCd ribbons oriented in the (1, 0, 0) direction. Mg is bonded in a linear geometry to one Pt and one Cd atom. The Mg–Pt bond length is 2.42 Å. The Mg–Cd bond length is 2.81 Å. Pt is bonded in a linear geometry to two equivalent Mg atoms. Cd is bonded in a linear geometry to two equivalent Mg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TbCdPt2 by Materials Project

TbPt2Cd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tb is bonded in a body-centered cubic geometry to eight equivalent Pt atoms. All Tb–Pt bond lengths are 2.95 Å. Pt is bonded in a body-centered cubic geometry to four equivalent Tb and four equivalent Cd atoms. All Pt–Cd bond lengths are 2.95 Å. Cd is bonded in a distorted body-centered cubic geometry to eight equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdRh2Pb by Materials Project

Rh2CdPb crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Rh2CdPb ribbons oriented in the (1, 0, 0) direction. Rh is bonded in a linear geometry to one Cd and one Pb atom. The Rh–Cd bond length is 2.72 Å. The Rh–Pb bond length is 2.54 Å. Cd is bonded in a linear geometry to two equivalent Rh atoms. Pb is bonded in a linear geometry to two equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Cd3FeSe4 by Materials Project

Cd3FeSe4 is Enargite-like structured and crystallizes in the monoclinic Cm space group. The structure is three-dimensional. Fe2+ is bonded to four Se2- atoms to form FeSe4 tetrahedra that share corners with six equivalent FeSe4 tetrahedra and corners with six CdSe4 tetrahedra. There are a spread of Fe–Se bond distances ranging from 2.48–2.56 Å. There are three inequivalent Cd2+ sites. In the first Cd2+ site, Cd2+ is bonded to four Se2- atoms to form CdSe4 tetrahedra that share corners with three equivalent FeSe4 tetrahedra and corners with nine CdSe4 tetrahedra. There are three shorter (2.68 Å) and one longer (2.69 Å) Cd–Se bond lengths. In the second Cd2+ site, Cd2+ is bonded to four Se2- atoms to form CdSe4 tetrahedra that share corners with three equivalent FeSe4 tetrahedra and corners with nine CdSe4 tetrahedra. All Cd–Se bond lengths are 2.68 Å. In the third Cd2+ site, Cd2+ is bonded to four Se2- atoms to form corner-sharing CdSe4 tetrahedra. There are a spread of Cd–Se bond distances ranging from 2.67–2.69 Å. There are four inequivalent Se2- sites. In the first Se2- site, Se2- is bonded to three equivalent Fe2+ and one Cd2+ atom to form corner-sharing SeCdFe3 tetrahedra. In the second Se2- site, Se2- is bonded to four Cd2+ atoms to form corner-sharing SeCd4 tetrahedra. In the third Se2- site, Se2- is bonded to four Cd2+ atoms to form corner-sharing SeCd4 tetrahedra. In the fourth Se2- site, Se2- is bonded to one Fe2+ and three equivalent Cd2+ atoms to form corner-sharing SeCd3Fe tetrahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CsCdInTe3 by Materials Project

CsCdInTe3 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six Te2- atoms. There are two shorter (3.91 Å) and four longer (4.02 Å) Cs–Te bond lengths. There are three inequivalent Cd2+ sites. In the first Cd2+ site, Cd2+ is bonded to four Te2- atoms to form CdTe4 tetrahedra that share corners with four equivalent CdTe4 tetrahedra and corners with four InTe4 tetrahedra. There are two shorter (2.86 Å) and two longer (2.89 Å) Cd–Te bond lengths. In the second Cd2+ site, Cd2+ is bonded to four Te2- atoms to form CdTe4 tetrahedra that share corners with four equivalent CdTe4 tetrahedra and corners with four InTe4 tetrahedra. There are two shorter (2.86 Å) and two longer (2.88 Å) Cd–Te bond lengths. In the third Cd2+ site, Cd2+ is bonded to four Te2- atoms to form CdTe4 tetrahedra that share corners with four CdTe4 tetrahedra and corners with four InTe4 tetrahedra. There are two shorter (2.86 Å) and two longer (2.88 Å) Cd–Te bond lengths. There are two inequivalent In3+ sites. In the first In3+ site, In3+ is bonded to four Te2- atoms to form InTe4 tetrahedra that share corners with two equivalent InTe4 tetrahedra and corners with four CdTe4 tetrahedra. There are two shorter (2.82 Å) and two longer (2.86 Å) In–Te bond lengths. In the second In3+ site, In3+ is bonded to four Te2- atoms to form InTe4 tetrahedra that share corners with two equivalent InTe4 tetrahedra and corners with four CdTe4 tetrahedra. There are two shorter (2.82 Å) and two longer (2.86 Å) In–Te bond lengths. There are six inequivalent Te2- sites. In the first Te2- site, Te2- is bonded in a 3-coordinate geometry to two equivalent Cs1+, two Cd2+, and one In3+ atom. In the second Te2- site, Te2- is bonded in a 5-coordinate geometry to two equivalent Cs1+, two Cd2+, and one In3+ atom. In the third Te2- site, Te2- is bonded in a distorted rectangular see-saw-like geometry to two equivalent Cs1+ and two In3+ atoms. In the fourth Te2- site, Te2- is bonded in a 3-coordinate geometry to two equivalent Cs1+, two Cd2+, and one In3+ atom. In the fifth Te2- site, Te2- is bonded in a distorted rectangular see-saw-like geometry to two equivalent Cs1+ and two In3+ atoms. In the sixth Te2- site, Te2- is bonded in a 5-coordinate geometry to two equivalent Cs1+, two Cd2+, and one In3+ atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Sc2CdHg by Materials Project

Sc2HgCd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sc is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent Cd atoms. All Sc–Hg bond lengths are 3.06 Å. All Sc–Cd bond lengths are 3.06 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Sc atoms. Cd is bonded in a body-centered cubic geometry to eight equivalent Sc atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ac2CdHg by Materials Project

Ac2HgCd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ac is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent Cd atoms. All Ac–Hg bond lengths are 3.52 Å. All Ac–Cd bond lengths are 3.52 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Ac atoms. Cd is bonded in a body-centered cubic geometry to eight equivalent Ac atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdInAg2 by Materials Project

Ag2CdIn crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Ag2CdIn ribbons oriented in the (1, 0, 0) direction. Ag is bonded in a linear geometry to one Cd and one In atom. The Ag–Cd bond length is 2.74 Å. The Ag–In bond length is 2.73 Å. Cd is bonded in a linear geometry to two equivalent Ag atoms. In is bonded in a linear geometry to two equivalent Ag atoms.

36 MATERIALS SCIENCE↗

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