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At least 1,459 records · Page 81
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DOE OSTI2020

Materials Data on YbIn2Pd by Materials Project

YbPdIn2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb is bonded in a 1-coordinate geometry to three equivalent Pd and ten equivalent In atoms. There are one shorter (2.91 Å) and two longer (3.15 Å) Yb–Pd bond lengths. There are a spread of Yb–In bond distances ranging from 3.36–3.48 Å. Pd is bonded in a 9-coordinate geometry to three equivalent Yb and six equivalent In atoms. There are two shorter (2.80 Å) and four longer (2.84 Å) Pd–In bond lengths. In is bonded in a 3-coordinate geometry to five equivalent Yb and three equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on MnSnPd2 by Materials Project

Pd2MnSn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mn is bonded in a body-centered cubic geometry to eight equivalent Pd atoms. All Mn–Pd bond lengths are 2.79 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Mn and four equivalent Sn atoms. All Pd–Sn bond lengths are 2.79 Å. Sn is bonded in a distorted body-centered cubic geometry to eight equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbSbPd by Materials Project

YbPdSb crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Yb is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Sb atoms. There are a spread of Yb–Pd bond distances ranging from 3.18–3.44 Å. There are a spread of Yb–Sb bond distances ranging from 3.22–3.38 Å. Pd is bonded in a 10-coordinate geometry to six equivalent Yb and four equivalent Sb atoms. There are a spread of Pd–Sb bond distances ranging from 2.71–2.86 Å. Sb is bonded in a 10-coordinate geometry to six equivalent Yb and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li2BPd3 by Materials Project

Li2Pd3B crystallizes in the cubic P4_332 space group. The structure is three-dimensional. Li is bonded to three equivalent Li and nine equivalent Pd atoms to form distorted LiLi3Pd9 cuboctahedra that share corners with fifteen equivalent LiLi3Pd9 cuboctahedra, edges with three equivalent BPd6 octahedra, faces with ten equivalent LiLi3Pd9 cuboctahedra, and faces with four equivalent BPd6 octahedra. All Li–Li bond lengths are 2.60 Å. There are a spread of Li–Pd bond distances ranging from 2.76–2.88 Å. Pd is bonded in a 8-coordinate geometry to six equivalent Li and two equivalent B atoms. Both Pd–B bond lengths are 2.16 Å. B is bonded to six equivalent Pd atoms to form distorted BPd6 octahedra that share corners with six equivalent BPd6 octahedra, edges with six equivalent LiLi3Pd9 cuboctahedra, and faces with eight equivalent LiLi3Pd9 cuboctahedra. The corner-sharing octahedral tilt angles are 28°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuPPd by Materials Project

EuPdP is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Eu is bonded to six equivalent Pd and six equivalent P atoms to form a mixture of edge and face-sharing EuP6Pd6 cuboctahedra. All Eu–Pd bond lengths are 3.19 Å. All Eu–P bond lengths are 3.19 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Eu and three equivalent P atoms. All Pd–P bond lengths are 2.40 Å. P is bonded in a 9-coordinate geometry to six equivalent Eu and three equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LaInPd2 by Materials Project

LaPd2In crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eight equivalent Pd atoms. There are two shorter (3.08 Å) and six longer (3.16 Å) La–Pd bond lengths. Pd is bonded in a 7-coordinate geometry to four equivalent La and three equivalent In atoms. All Pd–In bond lengths are 2.82 Å. In is bonded to six equivalent Pd atoms to form distorted edge-sharing InPd6 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiSi3Pd by Materials Project

LiPdSi3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Li is bonded in a 9-coordinate geometry to four equivalent Pd and five Si atoms. All Li–Pd bond lengths are 2.94 Å. There are one shorter (2.65 Å) and four longer (2.76 Å) Li–Si bond lengths. Pd is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Si atoms. All Pd–Si bond lengths are 2.60 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 8-coordinate geometry to two equivalent Li and six Si atoms. There are four shorter (2.42 Å) and two longer (2.61 Å) Si–Si bond lengths. In the second Si site, Si is bonded in a 5-coordinate geometry to one Li, four equivalent Pd, and four equivalent Si atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on USnPd by Materials Project

UPdSn crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. U is bonded in a 12-coordinate geometry to two equivalent U, six equivalent Pd, and six equivalent Sn atoms. Both U–U bond lengths are 2.89 Å. All U–Pd bond lengths are 3.22 Å. There are three shorter (3.22 Å) and three longer (3.23 Å) U–Sn bond lengths. Pd is bonded in a 11-coordinate geometry to six equivalent U and five equivalent Sn atoms. There are four shorter (2.88 Å) and one longer (2.90 Å) Pd–Sn bond lengths. Sn is bonded in a 11-coordinate geometry to six equivalent U and five equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ErGePd2 by Materials Project

ErPd2Ge is delta Molybdenum Boride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Er is bonded in a 11-coordinate geometry to eight equivalent Pd and three equivalent Ge atoms. There are a spread of Er–Pd bond distances ranging from 3.04–3.16 Å. There are a spread of Er–Ge bond distances ranging from 2.98–3.04 Å. Pd is bonded in a 12-coordinate geometry to four equivalent Er and three equivalent Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.53–2.66 Å. Ge is bonded in a 9-coordinate geometry to three equivalent Er and six equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on UGa3Pd2 by Materials Project

UPd2Ga3 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. U is bonded in a distorted hexagonal planar geometry to six equivalent Pd atoms. All U–Pd bond lengths are 3.08 Å. Pd is bonded in a 12-coordinate geometry to three equivalent U and six equivalent Ga atoms. All Pd–Ga bond lengths are 2.65 Å. Ga is bonded in a 12-coordinate geometry to four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdBPd3 by Materials Project

GdPd3B is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Gd is bonded to twelve equivalent Pd atoms to form GdPd12 cuboctahedra that share corners with twelve equivalent GdPd12 cuboctahedra, faces with six equivalent GdPd12 cuboctahedra, and faces with eight equivalent BPd6 octahedra. All Gd–Pd bond lengths are 3.04 Å. Pd is bonded to four equivalent Gd and two equivalent B atoms to form a mixture of distorted face, edge, and corner-sharing PdGd4B2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Pd–B bond lengths are 2.15 Å. B is bonded to six equivalent Pd atoms to form BPd6 octahedra that share corners with six equivalent BPd6 octahedra and faces with eight equivalent GdPd12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on DySnPd2 by Materials Project

Pd2DySn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Dy is bonded in a body-centered cubic geometry to eight equivalent Pd and six equivalent Sn atoms. All Dy–Pd bond lengths are 2.94 Å. All Dy–Sn bond lengths are 3.40 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Dy and four equivalent Sn atoms. All Pd–Sn bond lengths are 2.94 Å. Sn is bonded in a distorted body-centered cubic geometry to six equivalent Dy and eight equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SrIn2Pd by Materials Project

SrPdIn2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Sr is bonded in a 1-coordinate geometry to three equivalent Pd and ten equivalent In atoms. There are one shorter (3.08 Å) and two longer (3.33 Å) Sr–Pd bond lengths. There are a spread of Sr–In bond distances ranging from 3.50–3.63 Å. Pd is bonded in a 9-coordinate geometry to three equivalent Sr and six equivalent In atoms. There are two shorter (2.82 Å) and four longer (2.89 Å) Pd–In bond lengths. In is bonded in a 3-coordinate geometry to five equivalent Sr and three equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li2InPd by Materials Project

Li2PdIn crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to four equivalent In atoms to form distorted corner-sharing LiIn4 tetrahedra. All Li–In bond lengths are 2.78 Å. In the second Li site, Li is bonded to four equivalent Pd atoms to form distorted corner-sharing LiPd4 tetrahedra. All Li–Pd bond lengths are 2.78 Å. Pd is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent In atoms. All Pd–In bond lengths are 2.78 Å. In is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pd3PbC by Materials Project

Pd3PbC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pd is bonded in a linear geometry to four equivalent Pb and two equivalent C atoms. All Pd–Pb bond lengths are 3.04 Å. Both Pd–C bond lengths are 2.15 Å. Pb is bonded to twelve equivalent Pd atoms to form PbPd12 cuboctahedra that share corners with twelve equivalent PbPd12 cuboctahedra, faces with six equivalent PbPd12 cuboctahedra, and faces with eight equivalent CPd6 octahedra. C is bonded to six equivalent Pd atoms to form CPd6 octahedra that share corners with six equivalent CPd6 octahedra and faces with eight equivalent PbPd12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on La(GePd)2 by Materials Project

LaPd2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eight equivalent Pd and eight equivalent Ge atoms. All La–Pd bond lengths are 3.37 Å. All La–Ge bond lengths are 3.37 Å. Pd is bonded in a 4-coordinate geometry to four equivalent La and four equivalent Ge atoms. All Pd–Ge bond lengths are 2.55 Å. Ge is bonded in a 9-coordinate geometry to four equivalent La, four equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.53 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GdSbPd by Materials Project

GdPdSb crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Gd is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Sb atoms. There are three shorter (2.98 Å) and three longer (3.62 Å) Gd–Pd bond lengths. There are three shorter (3.17 Å) and three longer (3.37 Å) Gd–Sb bond lengths. Pd is bonded in a 10-coordinate geometry to six equivalent Gd and four equivalent Sb atoms. There are three shorter (2.77 Å) and one longer (3.03 Å) Pd–Sb bond lengths. Sb is bonded in a 10-coordinate geometry to six equivalent Gd and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on USiPd by Materials Project

UPdSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. U is bonded in a 11-coordinate geometry to six equivalent Pd and five equivalent Si atoms. There are a spread of U–Pd bond distances ranging from 3.05–3.25 Å. There are a spread of U–Si bond distances ranging from 2.94–3.01 Å. Pd is bonded in a 10-coordinate geometry to six equivalent U and four equivalent Si atoms. There are a spread of Pd–Si bond distances ranging from 2.53–2.64 Å. Si is bonded in a 9-coordinate geometry to five equivalent U and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗