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At least 1,117 records · Page 62
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DOE OSTI2020

Materials Data on CuSnPd2 by Materials Project

Pd2CuSn crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Pd is bonded to four equivalent Pd, four equivalent Cu, and four equivalent Sn atoms to form distorted PdCu4Sn4Pd4 cuboctahedra that share corners with twelve equivalent PdCu4Sn4Pd4 cuboctahedra, edges with eight equivalent PdCu4Sn4Pd4 cuboctahedra, edges with eight equivalent CuSn4Pd8 cuboctahedra, edges with eight equivalent SnCu4Pd8 cuboctahedra, faces with four equivalent CuSn4Pd8 cuboctahedra, faces with four equivalent SnCu4Pd8 cuboctahedra, and faces with ten equivalent PdCu4Sn4Pd4 cuboctahedra. All Pd–Pd bond lengths are 2.83 Å. All Pd–Cu bond lengths are 2.80 Å. All Pd–Sn bond lengths are 2.80 Å. Cu is bonded to eight equivalent Pd and four equivalent Sn atoms to form CuSn4Pd8 cuboctahedra that share corners with twelve equivalent CuSn4Pd8 cuboctahedra, edges with eight equivalent SnCu4Pd8 cuboctahedra, edges with sixteen equivalent PdCu4Sn4Pd4 cuboctahedra, faces with four equivalent SnCu4Pd8 cuboctahedra, faces with six equivalent CuSn4Pd8 cuboctahedra, and faces with eight equivalent PdCu4Sn4Pd4 cuboctahedra. All Cu–Sn bond lengths are 2.83 Å. Sn is bonded to eight equivalent Pd and four equivalent Cu atoms to form SnCu4Pd8 cuboctahedra that share corners with twelve equivalent SnCu4Pd8 cuboctahedra, edges with eight equivalent CuSn4Pd8 cuboctahedra, edges with sixteen equivalent PdCu4Sn4Pd4 cuboctahedra, faces with four equivalent CuSn4Pd8 cuboctahedra, faces with six equivalent SnCu4Pd8 cuboctahedra, and faces with eight equivalent PdCu4Sn4Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdSiPd by Materials Project

GdPdSi crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Gd is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Si atoms. There are a spread of Gd–Pd bond distances ranging from 3.00–3.24 Å. There are a spread of Gd–Si bond distances ranging from 3.06–3.20 Å. Pd is bonded in a 10-coordinate geometry to six equivalent Gd, one Pd, and three equivalent Si atoms. The Pd–Pd bond length is 2.94 Å. There are two shorter (2.49 Å) and one longer (2.81 Å) Pd–Si bond lengths. Si is bonded in a 10-coordinate geometry to six equivalent Gd, three equivalent Pd, and one Si atom. The Si–Si bond length is 2.43 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ErGePd by Materials Project

ErPdGe crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Er is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Ge atoms. There are a spread of Er–Pd bond distances ranging from 3.06–3.19 Å. There are a spread of Er–Ge bond distances ranging from 3.05–3.25 Å. Pd is bonded in a 10-coordinate geometry to six equivalent Er, one Pd, and three equivalent Ge atoms. The Pd–Pd bond length is 2.83 Å. There are two shorter (2.52 Å) and one longer (2.77 Å) Pd–Ge bond lengths. Ge is bonded in a 10-coordinate geometry to six equivalent Er, three equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.59 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LaGaPd2 by Materials Project

LaPd2Ga crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. La is bonded in a 11-coordinate geometry to ten equivalent Pd and three equivalent Ga atoms. There are a spread of La–Pd bond distances ranging from 3.10–3.78 Å. There are two shorter (3.19 Å) and one longer (3.21 Å) La–Ga bond lengths. Pd is bonded in a 12-coordinate geometry to five equivalent La, four equivalent Pd, and three equivalent Ga atoms. There are a spread of Pd–Pd bond distances ranging from 2.80–3.26 Å. There are a spread of Pd–Ga bond distances ranging from 2.60–2.71 Å. Ga is bonded in a 9-coordinate geometry to three equivalent La and six equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YGePd by Materials Project

YPdGe crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Y is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Ge atoms. There are a spread of Y–Pd bond distances ranging from 3.07–3.22 Å. There are a spread of Y–Ge bond distances ranging from 3.06–3.27 Å. Pd is bonded in a 10-coordinate geometry to six equivalent Y, one Pd, and three equivalent Ge atoms. The Pd–Pd bond length is 2.85 Å. There are two shorter (2.53 Å) and one longer (2.79 Å) Pd–Ge bond lengths. Ge is bonded in a 10-coordinate geometry to six equivalent Y, three equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.60 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TbSiPd2 by Materials Project

TbPd2Si is delta Molybdenum Boride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Tb is bonded in a 11-coordinate geometry to ten equivalent Pd and three equivalent Si atoms. There are a spread of Tb–Pd bond distances ranging from 2.98–3.53 Å. There are a spread of Tb–Si bond distances ranging from 2.99–3.03 Å. Pd is bonded in a 12-coordinate geometry to five equivalent Tb, four equivalent Pd, and three equivalent Si atoms. There are a spread of Pd–Pd bond distances ranging from 2.78–3.07 Å. There are a spread of Pd–Si bond distances ranging from 2.50–2.63 Å. Si is bonded in a 9-coordinate geometry to three equivalent Tb and six equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LaSbPd by Materials Project

LaPdSb crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. La is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Sb atoms. There are three shorter (3.18 Å) and three longer (3.45 Å) La–Pd bond lengths. There are three shorter (3.36 Å) and three longer (3.67 Å) La–Sb bond lengths. Pd is bonded in a 10-coordinate geometry to six equivalent La, three equivalent Pd, and one Sb atom. All Pd–Pd bond lengths are 2.89 Å. The Pd–Sb bond length is 3.21 Å. Sb is bonded in a 10-coordinate geometry to six equivalent La, one Pd, and three equivalent Sb atoms. All Sb–Sb bond lengths are 2.89 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Nd2Ge3Pd by Materials Project

Nd2PdGe3 is hexagonal omega structure-derived structured and crystallizes in the orthorhombic Pmm2 space group. The structure is three-dimensional. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded to two equivalent Pd and ten Ge atoms to form a mixture of edge and face-sharing NdGe10Pd2 cuboctahedra. Both Nd–Pd bond lengths are 3.24 Å. There are a spread of Nd–Ge bond distances ranging from 3.24–3.29 Å. In the second Nd site, Nd is bonded to four equivalent Pd and eight Ge atoms to form a mixture of edge and face-sharing NdGe8Pd4 cuboctahedra. All Nd–Pd bond lengths are 3.27 Å. There are a spread of Nd–Ge bond distances ranging from 3.20–3.25 Å. Pd is bonded in a 3-coordinate geometry to six Nd and three Ge atoms. There are one shorter (2.45 Å) and two longer (2.47 Å) Pd–Ge bond lengths. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six Nd and three Ge atoms. There are one shorter (2.49 Å) and two longer (2.52 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a 2-coordinate geometry to six Nd, two equivalent Pd, and one Ge atom. In the third Ge site, Ge is bonded in a 1-coordinate geometry to six Nd, one Pd, and two equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Dy2Ge6Pd by Materials Project

Dy2PdGe6 crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. Dy is bonded to two equivalent Pd and ten Ge atoms to form a mixture of distorted corner, edge, and face-sharing DyGe10Pd2 cuboctahedra. There are one shorter (3.17 Å) and one longer (3.18 Å) Dy–Pd bond lengths. There are a spread of Dy–Ge bond distances ranging from 2.98–3.40 Å. Pd is bonded in a 9-coordinate geometry to four equivalent Dy and five Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.46–2.54 Å. There are five inequivalent Ge sites. In the first Ge site, Ge is bonded in a 1-coordinate geometry to two equivalent Dy, one Pd, and three Ge atoms. There are one shorter (2.54 Å) and two longer (2.57 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a 1-coordinate geometry to two equivalent Dy, one Pd, and three Ge atoms. Both Ge–Ge bond lengths are 2.57 Å. In the third Ge site, Ge is bonded in a 1-coordinate geometry to two equivalent Dy, one Pd, and three Ge atoms. The Ge–Ge bond length is 2.52 Å. In the fourth Ge site, Ge is bonded in a 8-coordinate geometry to six equivalent Dy and two Ge atoms. There are one shorter (2.55 Å) and one longer (2.70 Å) Ge–Ge bond lengths. In the fifth Ge site, Ge is bonded in a 9-coordinate geometry to six equivalent Dy, one Pd, and two Ge atoms. The Ge–Ge bond length is 2.48 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Lu2CdPd2 by Materials Project

Lu2Pd2Cd crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Lu is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent Cd atoms. There are two shorter (2.82 Å) and four longer (2.95 Å) Lu–Pd bond lengths. All Lu–Cd bond lengths are 3.37 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Lu, one Pd, and two equivalent Cd atoms. The Pd–Pd bond length is 2.78 Å. Both Pd–Cd bond lengths are 3.01 Å. Cd is bonded to eight equivalent Lu and four equivalent Pd atoms to form a mixture of distorted face and corner-sharing CdLu8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbSiPd2 by Materials Project

YbPd2Si crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Yb is bonded in a 2-coordinate geometry to ten equivalent Pd and three equivalent Si atoms. There are a spread of Yb–Pd bond distances ranging from 2.91–3.43 Å. There are a spread of Yb–Si bond distances ranging from 2.97–3.00 Å. Pd is bonded in a 12-coordinate geometry to five equivalent Yb, four equivalent Pd, and three equivalent Si atoms. There are a spread of Pd–Pd bond distances ranging from 2.74–3.10 Å. There are a spread of Pd–Si bond distances ranging from 2.49–2.56 Å. Si is bonded in a 9-coordinate geometry to three equivalent Yb and six equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YSiPd by Materials Project

YPdSi crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Y is bonded in a 11-coordinate geometry to six equivalent Pd and six equivalent Si atoms. There are a spread of Y–Pd bond distances ranging from 3.05–3.17 Å. There are a spread of Y–Si bond distances ranging from 3.00–3.34 Å. Pd is bonded in a 10-coordinate geometry to six equivalent Y, one Pd, and three equivalent Si atoms. The Pd–Pd bond length is 2.95 Å. There are two shorter (2.48 Å) and one longer (2.70 Å) Pd–Si bond lengths. Si is bonded in a 10-coordinate geometry to six equivalent Y, three equivalent Pd, and one Si atom. The Si–Si bond length is 2.44 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tb(PPd)2 by Materials Project

Tb(PdP)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Tb is bonded in a 8-coordinate geometry to eight equivalent Pd and eight equivalent P atoms. All Tb–Pd bond lengths are 3.22 Å. All Tb–P bond lengths are 3.10 Å. Pd is bonded to four equivalent Tb, four equivalent Pd, and four equivalent P atoms to form a mixture of distorted face, edge, and corner-sharing PdTb4P4Pd4 cuboctahedra. All Pd–Pd bond lengths are 2.90 Å. All Pd–P bond lengths are 2.47 Å. P is bonded in a 9-coordinate geometry to four equivalent Tb, four equivalent Pd, and one P atom. The P–P bond length is 2.20 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TbPPd by Materials Project

TbPdP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Tb is bonded in a 11-coordinate geometry to six equivalent Pd and five equivalent P atoms. There are a spread of Tb–Pd bond distances ranging from 3.02–3.27 Å. There are a spread of Tb–P bond distances ranging from 2.86–2.93 Å. Pd is bonded in a 12-coordinate geometry to six equivalent Tb, two equivalent Pd, and four equivalent P atoms. Both Pd–Pd bond lengths are 3.06 Å. There are three shorter (2.56 Å) and one longer (2.80 Å) Pd–P bond lengths. P is bonded in a 9-coordinate geometry to five equivalent Tb and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on DySiPd2 by Materials Project

DyPd2Si crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Dy is bonded in a 11-coordinate geometry to ten equivalent Pd and three equivalent Si atoms. There are a spread of Dy–Pd bond distances ranging from 2.97–3.52 Å. There are a spread of Dy–Si bond distances ranging from 2.98–3.02 Å. Pd is bonded in a 12-coordinate geometry to five equivalent Dy, four equivalent Pd, and three equivalent Si atoms. There are a spread of Pd–Pd bond distances ranging from 2.77–3.05 Å. There are a spread of Pd–Si bond distances ranging from 2.49–2.62 Å. Si is bonded in a 9-coordinate geometry to three equivalent Dy and six equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Er(PPd)2 by Materials Project

Er(PdP)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to eight equivalent Pd and eight equivalent P atoms. All Er–Pd bond lengths are 3.21 Å. All Er–P bond lengths are 3.09 Å. Pd is bonded to four equivalent Er, four equivalent Pd, and four equivalent P atoms to form a mixture of distorted corner, edge, and face-sharing PdEr4P4Pd4 cuboctahedra. All Pd–Pd bond lengths are 2.89 Å. All Pd–P bond lengths are 2.47 Å. P is bonded in a 9-coordinate geometry to four equivalent Er, four equivalent Pd, and one P atom. The P–P bond length is 2.19 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CuNiPd by Materials Project

PdCuNi crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Pd is bonded to six equivalent Pd, three equivalent Ni, and three equivalent Cu atoms to form PdCu3Ni3Pd6 cuboctahedra that share corners with three equivalent NiCu3Ni6Pd3 cuboctahedra, corners with three equivalent CuCu6Ni3Pd3 cuboctahedra, corners with six equivalent PdCu3Ni3Pd6 cuboctahedra, edges with six equivalent PdCu3Ni3Pd6 cuboctahedra, edges with nine equivalent NiCu3Ni6Pd3 cuboctahedra, edges with nine equivalent CuCu6Ni3Pd3 cuboctahedra, faces with six equivalent PdCu3Ni3Pd6 cuboctahedra, faces with six equivalent NiCu3Ni6Pd3 cuboctahedra, and faces with six equivalent CuCu6Ni3Pd3 cuboctahedra. All Pd–Pd bond lengths are 2.66 Å. All Pd–Ni bond lengths are 2.66 Å. All Pd–Cu bond lengths are 2.69 Å. Ni is bonded to three equivalent Pd, six equivalent Ni, and three equivalent Cu atoms to form NiCu3Ni6Pd3 cuboctahedra that share corners with three equivalent PdCu3Ni3Pd6 cuboctahedra, corners with three equivalent CuCu6Ni3Pd3 cuboctahedra, corners with six equivalent NiCu3Ni6Pd3 cuboctahedra, edges with six equivalent NiCu3Ni6Pd3 cuboctahedra, edges with nine equivalent PdCu3Ni3Pd6 cuboctahedra, edges with nine equivalent CuCu6Ni3Pd3 cuboctahedra, faces with six equivalent PdCu3Ni3Pd6 cuboctahedra, faces with six equivalent NiCu3Ni6Pd3 cuboctahedra, and faces with six equivalent CuCu6Ni3Pd3 cuboctahedra. All Ni–Ni bond lengths are 2.66 Å. All Ni–Cu bond lengths are 2.49 Å. Cu is bonded to three equivalent Pd, three equivalent Ni, and six equivalent Cu atoms to form CuCu6Ni3Pd3 cuboctahedra that share corners with three equivalent PdCu3Ni3Pd6 cuboctahedra, corners with three equivalent NiCu3Ni6Pd3 cuboctahedra, corners with six equivalent CuCu6Ni3Pd3 cuboctahedra, edges with six equivalent CuCu6Ni3Pd3 cuboctahedra, edges with nine equivalent PdCu3Ni3Pd6 cuboctahedra, edges with nine equivalent NiCu3Ni6Pd3 cuboctahedra, faces with six equivalent PdCu3Ni3Pd6 cuboctahedra, faces with six equivalent NiCu3Ni6Pd3 cuboctahedra, and faces with six equivalent CuCu6Ni3Pd3 cuboctahedra. All Cu–Cu bond lengths are 2.66 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ce2SnPd2 by Materials Project

Ce2Pd2Sn crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Ce is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent Sn atoms. There are two shorter (2.89 Å) and four longer (3.07 Å) Ce–Pd bond lengths. All Ce–Sn bond lengths are 3.45 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Ce, one Pd, and two equivalent Sn atoms. The Pd–Pd bond length is 2.82 Å. Both Pd–Sn bond lengths are 3.06 Å. Sn is bonded to eight equivalent Ce and four equivalent Pd atoms to form a mixture of face and corner-sharing SnCe8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗