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At least 991 records · Page 55
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DOE OSTI2020

Materials Data on CaHoCd2 by Materials Project

CaHoCd2 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 Cd atoms. All Ca–Cd bond lengths are 3.27 Å. Ho is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Ho–Cd bond lengths are 3.27 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Ho atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbCdNi4 by Materials Project

YbNi4Cd is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Yb is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent Cd atoms. All Yb–Ni bond lengths are 2.86 Å. All Yb–Cd bond lengths are 2.99 Å. Ni is bonded to three equivalent Yb, six equivalent Ni, and three equivalent Cd atoms to form a mixture of edge, corner, and face-sharing NiYb3Cd3Ni6 cuboctahedra. All Ni–Ni bond lengths are 2.44 Å. All Ni–Cd bond lengths are 2.86 Å. Cd is bonded in a 4-coordinate geometry to four equivalent Yb and twelve equivalent Ni atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdC2S2(N4Cl)2 by Materials Project

Cd(N2Cl)2(CN2S)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four amino-isothiocyanate molecules and two Cd(N2Cl)2 clusters. In each Cd(N2Cl)2 cluster, Cd2+ is bonded in a 2-coordinate geometry to two equivalent N+0.50- and two equivalent Cl1- atoms. Both Cd–N bond lengths are 3.01 Å. Both Cd–Cl bond lengths are 2.31 Å. There are two inequivalent N+0.50- sites. In the first N+0.50- site, N+0.50- is bonded in a single-bond geometry to one N+0.50- atom. The N–N bond length is 1.11 Å. In the second N+0.50- site, N+0.50- is bonded in a distorted bent 150 degrees geometry to one Cd2+ and one N+0.50- atom. Cl1- is bonded in a single-bond geometry to one Cd2+ atom.

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DOE OSTI2020

Materials Data on YCd2Ag by Materials Project

YAgCd2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two YAgCd2 ribbons oriented in the (1, 0, 0) direction. Y is bonded in a linear geometry to two equivalent Cd atoms. Both Y–Cd bond lengths are 3.28 Å. Ag is bonded in a linear geometry to two equivalent Cd atoms. Both Ag–Cd bond lengths are 2.76 Å. Cd is bonded in a linear geometry to one Y and one Ag atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pr2CdRh2 by Materials Project

Pr2Rh2Cd crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pr is bonded in a 6-coordinate geometry to six equivalent Rh and four equivalent Cd atoms. There are two shorter (2.94 Å) and four longer (3.07 Å) Pr–Rh bond lengths. All Pr–Cd bond lengths are 3.46 Å. Rh is bonded in a 9-coordinate geometry to six equivalent Pr, one Rh, and two equivalent Cd atoms. The Rh–Rh bond length is 2.74 Å. Both Rh–Cd bond lengths are 2.99 Å. Cd is bonded to eight equivalent Pr and four equivalent Rh atoms to form a mixture of distorted corner and face-sharing CdPr8Rh4 cuboctahedra.

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DOE OSTI2020

Materials Data on Cd2AgPt by Materials Project

PtAgCd2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two PtAgCd2 ribbons oriented in the (1, 0, 0) direction. Pt is bonded in a linear geometry to two equivalent Cd atoms. Both Pt–Cd bond lengths are 2.60 Å. Ag is bonded in a linear geometry to two equivalent Cd atoms. Both Ag–Cd bond lengths are 2.66 Å. Cd is bonded in a linear geometry to one Pt and one Ag atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LuCdNi4 by Materials Project

LuNi4Cd is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Lu is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent Cd atoms. All Lu–Ni bond lengths are 2.89 Å. All Lu–Cd bond lengths are 3.01 Å. Ni is bonded to three equivalent Lu, six equivalent Ni, and three equivalent Cd atoms to form a mixture of corner, edge, and face-sharing NiLu3Cd3Ni6 cuboctahedra. There are three shorter (2.45 Å) and three longer (2.47 Å) Ni–Ni bond lengths. All Ni–Cd bond lengths are 2.88 Å. Cd is bonded in a 4-coordinate geometry to four equivalent Lu and twelve equivalent Ni atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdClO by Materials Project

CdOCl crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Cd is bonded in a 3-coordinate geometry to three equivalent O and four equivalent Cl atoms. All Cd–O bond lengths are 2.27 Å. There are three shorter (2.80 Å) and one longer (3.06 Å) Cd–Cl bond lengths. O is bonded in a trigonal non-coplanar geometry to three equivalent Cd atoms. Cl is bonded in a distorted rectangular see-saw-like geometry to four equivalent Cd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SrAcCd2 by Materials Project

SrAcCd2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sr is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Sr–Cd bond lengths are 3.53 Å. Ac is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Ac–Cd bond lengths are 3.53 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Sr and four equivalent Ac atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbYCd2 by Materials Project

YbYCd2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Yb is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Yb–Cd bond lengths are 3.26 Å. Y is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Y–Cd bond lengths are 3.26 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tb2CdCu2 by Materials Project

Tb2Cu2Cd crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Tb is bonded in a 6-coordinate geometry to six equivalent Cu and four equivalent Cd atoms. There are two shorter (2.88 Å) and four longer (2.93 Å) Tb–Cu bond lengths. All Tb–Cd bond lengths are 3.36 Å. Cu is bonded in a 9-coordinate geometry to six equivalent Tb, one Cu, and two equivalent Cd atoms. The Cu–Cu bond length is 2.53 Å. Both Cu–Cd bond lengths are 3.07 Å. Cd is bonded to eight equivalent Tb and four equivalent Cu atoms to form a mixture of face and corner-sharing CdTb8Cu4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PrCdNi4 by Materials Project

PrNi4Cd is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Pr is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent Cd atoms. All Pr–Ni bond lengths are 2.97 Å. All Pr–Cd bond lengths are 3.10 Å. Ni is bonded to three equivalent Pr, six equivalent Ni, and three equivalent Cd atoms to form a mixture of face, edge, and corner-sharing NiPr3Cd3Ni6 cuboctahedra. There are three shorter (2.50 Å) and three longer (2.56 Å) Ni–Ni bond lengths. All Ni–Cd bond lengths are 2.97 Å. Cd is bonded in a 4-coordinate geometry to four equivalent Pr and twelve equivalent Ni atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on AcZn2Cd by Materials Project

AcCdZn2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ac is bonded in a distorted body-centered cubic geometry to six equivalent Cd and eight equivalent Zn atoms. All Ac–Cd bond lengths are 3.65 Å. All Ac–Zn bond lengths are 3.16 Å. Cd is bonded in a 8-coordinate geometry to six equivalent Ac and eight equivalent Zn atoms. All Cd–Zn bond lengths are 3.16 Å. Zn is bonded in a body-centered cubic geometry to four equivalent Ac and four equivalent Cd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YErCd2 by Materials Project

ErYCd2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Er is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Er–Cd bond lengths are 3.24 Å. Y is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Y–Cd bond lengths are 3.24 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Er and four equivalent Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Dy2CdCu2 by Materials Project

Dy2Cu2Cd crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Dy is bonded in a 6-coordinate geometry to six equivalent Cu and four equivalent Cd atoms. There are two shorter (2.88 Å) and four longer (2.93 Å) Dy–Cu bond lengths. All Dy–Cd bond lengths are 3.35 Å. Cu is bonded in a 9-coordinate geometry to six equivalent Dy, one Cu, and two equivalent Cd atoms. The Cu–Cu bond length is 2.53 Å. Both Cu–Cd bond lengths are 3.06 Å. Cd is bonded to eight equivalent Dy and four equivalent Cu atoms to form a mixture of face and corner-sharing CdDy8Cu4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tb2CdNi2 by Materials Project

Tb2Ni2Cd crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Tb is bonded in a 10-coordinate geometry to six equivalent Ni and four equivalent Cd atoms. There are four shorter (2.82 Å) and two longer (2.94 Å) Tb–Ni bond lengths. All Tb–Cd bond lengths are 3.31 Å. Ni is bonded in a 9-coordinate geometry to six equivalent Tb, two equivalent Ni, and one Cd atom. Both Ni–Ni bond lengths are 2.38 Å. The Ni–Cd bond length is 2.86 Å. Cd is bonded in a distorted q6 geometry to eight equivalent Tb and two equivalent Ni atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Na3Cd by Materials Project

Na3Cd is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Na sites. In the first Na site, Na is bonded to eight Na and four equivalent Cd atoms to form distorted NaNa8Cd4 cuboctahedra that share corners with twelve equivalent NaNa8Cd4 cuboctahedra, edges with eight equivalent NaNa8Cd4 cuboctahedra, edges with eight equivalent CdNa12 cuboctahedra, faces with four equivalent CdNa12 cuboctahedra, and faces with ten equivalent NaNa8Cd4 cuboctahedra. There are four shorter (3.43 Å) and four longer (3.55 Å) Na–Na bond lengths. All Na–Cd bond lengths are 3.55 Å. In the second Na site, Na is bonded in a distorted square co-planar geometry to eight equivalent Na and four equivalent Cd atoms. All Na–Cd bond lengths are 3.43 Å. Cd is bonded to twelve Na atoms to form CdNa12 cuboctahedra that share corners with four equivalent CdNa12 cuboctahedra, edges with eight equivalent CdNa12 cuboctahedra, edges with sixteen equivalent NaNa8Cd4 cuboctahedra, faces with four equivalent CdNa12 cuboctahedra, and faces with eight equivalent NaNa8Cd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdIn2SnAu2 by Materials Project

Au2CdIn2Sn is half-Heusler-derived structured and crystallizes in the trigonal R3m space group. The structure is three-dimensional. there are two inequivalent Au sites. In the first Au site, Au is bonded in a body-centered cubic geometry to three equivalent Cd, four In, and one Sn atom. All Au–Cd bond lengths are 2.91 Å. There are one shorter (2.86 Å) and three longer (2.88 Å) Au–In bond lengths. The Au–Sn bond length is 2.86 Å. In the second Au site, Au is bonded in a body-centered cubic geometry to one Cd, four In, and three equivalent Sn atoms. The Au–Cd bond length is 2.89 Å. All Au–In bond lengths are 2.92 Å. All Au–Sn bond lengths are 2.90 Å. Cd is bonded to four Au atoms to form CdAu4 tetrahedra that share corners with four equivalent InAu4 tetrahedra, corners with six equivalent CdAu4 tetrahedra, corners with six equivalent SnAu4 tetrahedra, and edges with six InAu4 tetrahedra. There are two inequivalent In sites. In the first In site, In is bonded to four Au atoms to form distorted InAu4 tetrahedra that share corners with four equivalent SnAu4 tetrahedra, corners with twelve InAu4 tetrahedra, edges with three equivalent CdAu4 tetrahedra, and edges with three equivalent SnAu4 tetrahedra. In the second In site, In is bonded to four Au atoms to form distorted InAu4 tetrahedra that share corners with four equivalent CdAu4 tetrahedra, corners with twelve InAu4 tetrahedra, edges with three equivalent CdAu4 tetrahedra, and edges with three equivalent SnAu4 tetrahedra. Sn is bonded to four Au atoms to form distorted SnAu4 tetrahedra that share corners with four equivalent InAu4 tetrahedra, corners with six equivalent CdAu4 tetrahedra, corners with six equivalent SnAu4 tetrahedra, and edges with six InAu4 tetrahedra.

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