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At least 1,063 records · Page 59
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DOE OSTI2020

Materials Data on Dy2CdPd2 by Materials Project

Dy2Pd2Cd crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Dy is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent Cd atoms. There are two shorter (2.87 Å) and four longer (3.00 Å) Dy–Pd bond lengths. All Dy–Cd bond lengths are 3.42 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Dy, one Pd, and two equivalent Cd atoms. The Pd–Pd bond length is 2.82 Å. Both Pd–Cd bond lengths are 3.03 Å. Cd is bonded to eight equivalent Dy and four equivalent Pd atoms to form a mixture of face and corner-sharing CdDy8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ErAsPd by Materials Project

ErPdAs crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Er is bonded in a 11-coordinate geometry to six equivalent Pd and five equivalent As atoms. There are a spread of Er–Pd bond distances ranging from 3.05–3.40 Å. There are a spread of Er–As bond distances ranging from 2.89–2.98 Å. Pd is bonded to six equivalent Er, two equivalent Pd, and four equivalent As atoms to form a mixture of distorted edge, face, and corner-sharing PdEr6As4Pd2 cuboctahedra. Both Pd–Pd bond lengths are 3.03 Å. There are a spread of Pd–As bond distances ranging from 2.62–2.81 Å. As is bonded in a 9-coordinate geometry to five equivalent Er and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y3Si3Pd2 by Materials Project

Y3Pd2Si3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 10-coordinate geometry to four equivalent Pd and six Si atoms. There are a spread of Y–Pd bond distances ranging from 3.06–3.16 Å. There are a spread of Y–Si bond distances ranging from 3.01–3.11 Å. In the second Y site, Y is bonded in a 9-coordinate geometry to four equivalent Pd and five Si atoms. All Y–Pd bond lengths are 3.15 Å. There are a spread of Y–Si bond distances ranging from 3.00–3.10 Å. Pd is bonded in a 10-coordinate geometry to six Y and four Si atoms. There are a spread of Pd–Si bond distances ranging from 2.50–2.74 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to seven Y and two equivalent Pd atoms. In the second Si site, Si is bonded in a 10-coordinate geometry to five Y, three equivalent Pd, and one Si atom. The Si–Si bond length is 2.48 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on GaPd2 by Materials Project

Pd2Ga is Cotunnite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 5-coordinate geometry to five equivalent Ga atoms. There are a spread of Pd–Ga bond distances ranging from 2.59–2.89 Å. In the second Pd site, Pd is bonded in a 4-coordinate geometry to five equivalent Ga atoms. There are a spread of Pd–Ga bond distances ranging from 2.58–3.04 Å. Ga is bonded in a 10-coordinate geometry to ten Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pu2InPd2 by Materials Project

Pu2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Pu is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.84 Å) and four longer (2.99 Å) Pu–Pd bond lengths. All Pu–In bond lengths are 3.41 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Pu, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.88 Å. Both Pd–In bond lengths are 3.01 Å. In is bonded to eight equivalent Pu and four equivalent Pd atoms to form a mixture of face and corner-sharing InPu8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PPd3 by Materials Project

Pd3P is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 2-coordinate geometry to three equivalent P atoms. There are a spread of Pd–P bond distances ranging from 2.35–2.62 Å. In the second Pd site, Pd is bonded in a 2-coordinate geometry to two equivalent P atoms. There are one shorter (2.33 Å) and one longer (2.34 Å) Pd–P bond lengths. P is bonded in a 8-coordinate geometry to eight Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ce2InPd2 by Materials Project

Ce2Pd2In 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 In atoms. There are two shorter (2.89 Å) and four longer (3.07 Å) Ce–Pd bond lengths. All Ce–In bond lengths are 3.46 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Ce, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.86 Å. Both Pd–In bond lengths are 3.07 Å. In is bonded to eight equivalent Ce and four equivalent Pd atoms to form a mixture of corner and face-sharing InCe8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TiGePd by Materials Project

TiPdGe crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ti is bonded in a 11-coordinate geometry to six equivalent Pd and five equivalent Ge atoms. There are a spread of Ti–Pd bond distances ranging from 2.96–3.12 Å. There are a spread of Ti–Ge bond distances ranging from 2.67–2.82 Å. Pd is bonded in a 12-coordinate geometry to six equivalent Ti, two equivalent Pd, and four equivalent Ge atoms. Both Pd–Pd bond lengths are 2.84 Å. There are a spread of Pd–Ge bond distances ranging from 2.48–2.62 Å. Ge is bonded in a 9-coordinate geometry to five equivalent Ti and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on La2Pd2Pb by Materials Project

La2Pd2Pb crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. La is bonded in a 10-coordinate geometry to six equivalent Pd and four equivalent Pb atoms. There are two shorter (3.00 Å) and four longer (3.17 Å) La–Pd bond lengths. All La–Pb bond lengths are 3.56 Å. Pd is bonded in a 6-coordinate geometry to six equivalent La, one Pd, and two equivalent Pb atoms. The Pd–Pd bond length is 2.82 Å. Both Pd–Pb bond lengths are 3.18 Å. Pb is bonded to eight equivalent La and four equivalent Pd atoms to form a mixture of corner and face-sharing PbLa8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Sm2InPd2 by Materials Project

Sm2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Sm is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.91 Å) and four longer (3.07 Å) Sm–Pd bond lengths. All Sm–In bond lengths are 3.46 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Sm, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.81 Å. Both Pd–In bond lengths are 3.08 Å. In is bonded to eight equivalent Sm and four equivalent Pd atoms to form a mixture of face and corner-sharing InSm8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on BPd3 by Materials Project

Pd3B is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is two-dimensional and consists of two Pd3B sheets oriented in the (0, 0, 1) direction. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a bent 150 degrees geometry to two equivalent B atoms. There are one shorter (2.17 Å) and one longer (2.22 Å) Pd–B bond lengths. In the second Pd site, Pd is bonded in a distorted water-like geometry to two equivalent B atoms. There are one shorter (2.18 Å) and one longer (2.20 Å) Pd–B bond lengths. B is bonded in a 6-coordinate geometry to six Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on EuGePd by Materials Project

EuPdGe crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Eu is bonded in a 1-coordinate geometry to six equivalent Pd and six equivalent Ge atoms. There are a spread of Eu–Pd bond distances ranging from 3.06–3.57 Å. There are a spread of Eu–Ge bond distances ranging from 3.20–3.60 Å. Pd is bonded in a 10-coordinate geometry to six equivalent Eu, one Pd, and three equivalent Ge atoms. The Pd–Pd bond length is 2.95 Å. There are a spread of Pd–Ge bond distances ranging from 2.48–2.54 Å. Ge is bonded in a 3-coordinate geometry to six equivalent Eu, three equivalent Pd, and one Ge atom. The Ge–Ge bond length is 3.05 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SiPd3 by Materials Project

Pd3Si is Cementite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a bent 120 degrees geometry to two equivalent Si atoms. There are one shorter (2.38 Å) and one longer (2.40 Å) Pd–Si bond lengths. In the second Pd site, Pd is bonded in a 3-coordinate geometry to three equivalent Si atoms. There are a spread of Pd–Si bond distances ranging from 2.38–2.60 Å. Si is bonded in a 8-coordinate geometry to eight Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Gd2InPd2 by Materials Project

Gd2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Gd is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.89 Å) and four longer (3.04 Å) Gd–Pd bond lengths. All Gd–In bond lengths are 3.44 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Gd, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.82 Å. Both Pd–In bond lengths are 3.06 Å. In is bonded to eight equivalent Gd and four equivalent Pd atoms to form a mixture of face and corner-sharing InGd8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ca2InPd2 by Materials Project

Ca2Pd2In crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Ca is bonded in a 7-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are a spread of Ca–Pd bond distances ranging from 3.08–3.26 Å. There are a spread of Ca–In bond distances ranging from 3.43–3.50 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Ca, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.72 Å. There are one shorter (2.73 Å) and one longer (2.75 Å) Pd–In bond lengths. In is bonded in a 12-coordinate geometry to eight equivalent Ca and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Sr2InPd2 by Materials Project

Sr2Pd2In crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Sr is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are a spread of Sr–Pd bond distances ranging from 3.25–3.34 Å. There are a spread of Sr–In bond distances ranging from 3.60–3.65 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Sr, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.84 Å. There are one shorter (2.78 Å) and one longer (2.80 Å) Pd–In bond lengths. In is bonded in a 12-coordinate geometry to eight equivalent Sr and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Dy2InPd2 by Materials Project

Dy2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Dy is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.86 Å) and four longer (3.01 Å) Dy–Pd bond lengths. All Dy–In bond lengths are 3.41 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Dy, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.80 Å. Both Pd–In bond lengths are 3.04 Å. In is bonded to eight equivalent Dy and four equivalent Pd atoms to form a mixture of corner and face-sharing InDy8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tb2InPd2 by Materials Project

Tb2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Tb is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.87 Å) and four longer (3.02 Å) Tb–Pd bond lengths. All Tb–In bond lengths are 3.43 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Tb, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.80 Å. Both Pd–In bond lengths are 3.05 Å. In is bonded to eight equivalent Tb and four equivalent Pd atoms to form a mixture of corner and face-sharing InTb8Pd4 cuboctahedra.

36 MATERIALS SCIENCE↗