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At least 1,657 records · Page 92
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DOE OSTI2020

Materials Data on LuSiPt by Materials Project

LuPtSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Lu is bonded in a 12-coordinate geometry to six equivalent Pt and six equivalent Si atoms. There are a spread of Lu–Pt bond distances ranging from 2.93–3.20 Å. There are a spread of Lu–Si bond distances ranging from 2.94–3.15 Å. Pt is bonded in a 10-coordinate geometry to six equivalent Lu and four equivalent Si atoms. There are a spread of Pt–Si bond distances ranging from 2.49–2.66 Å. Si is bonded in a 10-coordinate geometry to six equivalent Lu and four equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on KPtBr3NO by Materials Project

KPtNOBr3 crystallizes in the orthorhombic Pbcn space group. The structure is three-dimensional. there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a 9-coordinate geometry to one N1-, two equivalent O2-, and six Br1- atoms. The K–N bond length is 2.93 Å. Both K–O bond lengths are 2.90 Å. There are a spread of K–Br bond distances ranging from 3.29–3.72 Å. In the second K1+ site, K1+ is bonded in a 8-coordinate geometry to two equivalent O2- and six Br1- atoms. There are one shorter (2.90 Å) and one longer (3.23 Å) K–O bond lengths. There are a spread of K–Br bond distances ranging from 3.36–3.75 Å. There are two inequivalent Pt5+ sites. In the first Pt5+ site, Pt5+ is bonded in a square co-planar geometry to one N1- and three Br1- atoms. The Pt–N bond length is 1.75 Å. There are two shorter (2.48 Å) and one longer (2.57 Å) Pt–Br bond lengths. In the second Pt5+ site, Pt5+ is bonded in a 2-coordinate geometry to one N1-, one O2-, and three Br1- atoms. The Pt–N bond length is 1.71 Å. The Pt–O bond length is 1.89 Å. There are a spread of Pt–Br bond distances ranging from 2.53–2.73 Å. There are two inequivalent N1- sites. In the first N1- site, N1- is bonded in a single-bond geometry to one Pt5+ atom. In the second N1- site, N1- is bonded in a distorted linear geometry to one K1+ and one Pt5+ atom. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 6-coordinate geometry to two equivalent K1+ and four equivalent Br1- atoms. There are two shorter (2.86 Å) and two longer (3.07 Å) O–Br bond lengths. In the second O2- site, O2- is bonded in a 1-coordinate geometry to two equivalent K1+, one Pt5+, and one Br1- atom. The O–Br bond length is 2.79 Å. There are five inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a 1-coordinate geometry to one K1+ and one Pt5+ atom. In the second Br1- site, Br1- is bonded in a distorted bent 120 degrees geometry to one K1+ and one Pt5+ atom. In the third Br1- site, Br1- is bonded in a 2-coordinate geometry to two K1+ and one Pt5+ atom. In the fourth Br1- site, Br1- is bonded in a 5-coordinate geometry to four equivalent K1+ and one Pt5+ atom. In the fifth Br1- site, Br1- is bonded in a 7-coordinate geometry to three K1+, one Pt5+, and three O2- atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiThPt2 by Materials Project

LiThPt2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Pt atoms. All Li–Pt bond lengths are 2.97 Å. Th is bonded in a body-centered cubic geometry to eight equivalent Pt atoms. All Th–Pt bond lengths are 2.97 Å. Pt is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Th atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y5BiPt2 by Materials Project

Y5Pt2Bi crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded to four equivalent Pt and two equivalent Bi atoms to form distorted corner-sharing YBi2Pt4 octahedra. The corner-sharing octahedra tilt angles range from 0–48°. All Y–Pt bond lengths are 3.03 Å. Both Y–Bi bond lengths are 3.49 Å. In the second Y site, Y is bonded in a 5-coordinate geometry to three equivalent Pt and two equivalent Bi atoms. There are one shorter (2.96 Å) and two longer (2.99 Å) Y–Pt bond lengths. Both Y–Bi bond lengths are 3.35 Å. Pt is bonded in a 8-coordinate geometry to eight Y atoms. Bi is bonded in a 10-coordinate geometry to ten Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CaCdPt by Materials Project

CaPtCd crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ca is bonded in a 5-coordinate geometry to five equivalent Pt atoms. There are a spread of Ca–Pt bond distances ranging from 3.07–3.12 Å. Pt is bonded in a 9-coordinate geometry to five equivalent Ca and four equivalent Cd atoms. There are a spread of Pt–Cd bond distances ranging from 2.78–2.87 Å. Cd is bonded in a 4-coordinate geometry to four equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on U3Sn4Pt3 by Materials Project

U3Pt3Sn4 crystallizes in the cubic I-43d space group. The structure is three-dimensional. U is bonded in a 12-coordinate geometry to four equivalent Pt and eight equivalent Sn atoms. All U–Pt bond lengths are 2.99 Å. There are four shorter (3.33 Å) and four longer (3.42 Å) U–Sn bond lengths. Pt is bonded in a 8-coordinate geometry to four equivalent U and four equivalent Sn atoms. All Pt–Sn bond lengths are 2.75 Å. Sn is bonded in a 3-coordinate geometry to six equivalent U and three equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Dy5BiPt2 by Materials Project

Dy5Pt2Bi crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent Dy sites. In the first Dy site, Dy is bonded to four equivalent Pt and two equivalent Bi atoms to form distorted corner-sharing DyBi2Pt4 octahedra. The corner-sharing octahedra tilt angles range from 0–48°. All Dy–Pt bond lengths are 3.02 Å. Both Dy–Bi bond lengths are 3.47 Å. In the second Dy site, Dy is bonded in a 5-coordinate geometry to three equivalent Pt and two equivalent Bi atoms. There are one shorter (2.94 Å) and two longer (2.98 Å) Dy–Pt bond lengths. Both Dy–Bi bond lengths are 3.34 Å. Pt is bonded in a 8-coordinate geometry to eight Dy atoms. Bi is bonded in a 10-coordinate geometry to ten Dy atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ErSiPt by Materials Project

ErPtSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Er is bonded in a 12-coordinate geometry to six equivalent Pt and six equivalent Si atoms. There are a spread of Er–Pt bond distances ranging from 2.99–3.16 Å. There are a spread of Er–Si bond distances ranging from 2.96–3.15 Å. Pt is bonded in a 10-coordinate geometry to six equivalent Er and four equivalent Si atoms. There are a spread of Pt–Si bond distances ranging from 2.50–2.70 Å. Si is bonded in a 10-coordinate geometry to six equivalent Er and four equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on DySiPt2 by Materials Project

DyPt2Si crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Dy is bonded in a 11-coordinate geometry to eight equivalent Pt and three equivalent Si atoms. There are a spread of Dy–Pt bond distances ranging from 3.00–3.17 Å. There are a spread of Dy–Si bond distances ranging from 2.98–3.02 Å. Pt is bonded in a 12-coordinate geometry to four equivalent Dy and three equivalent Si atoms. There are a spread of Pt–Si bond distances ranging from 2.50–2.63 Å. Si is bonded in a 9-coordinate geometry to three equivalent Dy and six equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TmSiPt by Materials Project

TmPtSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Tm is bonded in a 12-coordinate geometry to six equivalent Pt and six equivalent Si atoms. There are a spread of Tm–Pt bond distances ranging from 2.95–3.20 Å. There are a spread of Tm–Si bond distances ranging from 2.95–3.15 Å. Pt is bonded in a 10-coordinate geometry to six equivalent Tm and four equivalent Si atoms. There are a spread of Pt–Si bond distances ranging from 2.50–2.68 Å. Si is bonded in a 10-coordinate geometry to six equivalent Tm and four equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Na2Pt(ClO)6 by Materials Project

Na2Pt(OCl)6 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Na is bonded in a 6-coordinate geometry to three O and three Cl atoms. There are a spread of Na–O bond distances ranging from 2.65–2.82 Å. There are a spread of Na–Cl bond distances ranging from 2.71–2.95 Å. Pt is bonded in an octahedral geometry to six Cl atoms. There are four shorter (2.35 Å) and two longer (2.36 Å) Pt–Cl bond lengths. There are three inequivalent O sites. In the first O site, O is bonded in a distorted bent 120 degrees geometry to one Na and one O atom. The O–O bond length is 1.23 Å. In the second O site, O is bonded in a bent 120 degrees geometry to one Na and one O atom. The O–O bond length is 1.24 Å. In the third O site, O is bonded in a bent 150 degrees geometry to one Na and one O atom. There are three inequivalent Cl sites. In the first Cl site, Cl is bonded in a bent 150 degrees geometry to one Na and one Pt atom. In the second Cl site, Cl is bonded in an L-shaped geometry to one Na and one Pt atom. In the third Cl site, Cl is bonded in a water-like geometry to one Na and one Pt atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CaAlPt by Materials Project

CaPtAl crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ca is bonded in a 5-coordinate geometry to five equivalent Pt and six equivalent Al atoms. There are a spread of Ca–Pt bond distances ranging from 3.00–3.16 Å. There are a spread of Ca–Al bond distances ranging from 3.17–3.35 Å. Pt is bonded in a 9-coordinate geometry to five equivalent Ca and four equivalent Al atoms. There are a spread of Pt–Al bond distances ranging from 2.60–2.71 Å. Al is bonded in a 4-coordinate geometry to six equivalent Ca and four equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tb5Pt3 by Materials Project

Tb5Pt3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded in a 6-coordinate geometry to six equivalent Pt atoms. All Tb–Pt bond lengths are 3.04 Å. In the second Tb site, Tb is bonded in a 5-coordinate geometry to five equivalent Pt atoms. There are a spread of Tb–Pt bond distances ranging from 2.91–3.38 Å. Pt is bonded in a 9-coordinate geometry to nine Tb atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SrPPt by Materials Project

SrPtP is hexagonal omega structure-derived structured and crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Sr is bonded to six equivalent Pt and six equivalent P atoms to form a mixture of edge and face-sharing SrP6Pt6 cuboctahedra. All Sr–Pt bond lengths are 3.29 Å. All Sr–P bond lengths are 3.29 Å. Pt is bonded in a 3-coordinate geometry to six equivalent Sr and three equivalent P atoms. All Pt–P bond lengths are 2.39 Å. P is bonded in a 3-coordinate geometry to six equivalent Sr and three equivalent Pt atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ca3Sn13Pt4 by Materials Project

Ca3Pt4Sn13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Ca is bonded in a 12-coordinate geometry to four equivalent Pt and twelve equivalent Sn atoms. All Ca–Pt bond lengths are 3.51 Å. There are eight shorter (3.48 Å) and four longer (3.52 Å) Ca–Sn bond lengths. Pt is bonded in a 6-coordinate geometry to three equivalent Ca and six equivalent Sn atoms. All Pt–Sn bond lengths are 2.73 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 2-coordinate geometry to three equivalent Ca, two equivalent Pt, and one Sn atom. The Sn–Sn bond length is 3.40 Å. In the second Sn site, Sn is bonded in a cuboctahedral geometry to twelve equivalent Sn atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbYPt2 by Materials Project

YbYPt2 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 Pt atoms. All Yb–Pt bond lengths are 3.00 Å. Y is bonded in a body-centered cubic geometry to eight equivalent Pt atoms. All Y–Pt bond lengths are 3.00 Å. Pt 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 HfMgPt2 by Materials Project

MgHfPt2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two MgHfPt2 ribbons oriented in the (1, 0, 0) direction. Mg is bonded in a linear geometry to two equivalent Pt atoms. Both Mg–Pt bond lengths are 2.63 Å. Hf is bonded in a linear geometry to two equivalent Pt atoms. Both Hf–Pt bond lengths are 2.35 Å. Pt is bonded in a linear geometry to one Mg and one Hf atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NbPt4 by Materials Project

NbPt4 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Nb4+ is bonded in a hexagonal planar geometry to six equivalent Pt1- atoms. All Nb–Pt bond lengths are 2.80 Å. There are two inequivalent Pt1- sites. In the first Pt1- site, Pt1- is bonded to three equivalent Nb4+ and three equivalent Pt1- atoms to form a mixture of distorted edge and corner-sharing PtNb3Pt3 cuboctahedra. All Pt–Pt bond lengths are 2.88 Å. In the second Pt1- site, Pt1- is bonded to twelve Pt1- atoms to form PtPt12 cuboctahedra that share corners with fifteen PtNb3Pt3 cuboctahedra, edges with twenty-one PtNb3Pt3 cuboctahedra, and faces with twelve equivalent PtPt12 cuboctahedra. There are six shorter (2.83 Å) and three longer (2.84 Å) Pt–Pt bond lengths.

36 MATERIALS SCIENCE↗