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At least 955 records · Page 53

Materials Data on TbPd by Materials Project

TbPd is alpha-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Tb is bonded in a 7-coordinate geometry to seven equivalent Pd atoms. There are a spread of Tb–Pd bond distances ranging from 2.88–3.05 Å. Pd is bonded in a 7-coordinate geometry to seven equivalent Tb atoms.

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Materials Data on MgSn by Materials Project

MgSn is alpha-derived structured and crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Mg is bonded in a 7-coordinate geometry to seven equivalent Sn atoms. There are a spread of Mg–Sn bond distances ranging from 3.03–3.20 Å. Sn is bonded in a 7-coordinate geometry to seven equivalent Mg atoms.

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Materials Data on KVO4 by Materials Project

KVO4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. K is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of K–O bond distances ranging from 2.73–3.44 Å. V is bonded in a 5-coordinate geometry to five O atoms. There are a spread of V–O bond distances ranging from 1.68–2.03 Å. There are four inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to four equivalent K and one V atom. In the second O site, O is bonded in a single-bond geometry to two equivalent K and one V atom. In the third O site, O is bonded in a distorted trigonal non-coplanar geometry to three equivalent V atoms. In the fourth O site, O is bonded in a 2-coordinate geometry to two equivalent K atoms.

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Materials Data on NdSI by Materials Project

NdSI crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. Nd3+ is bonded in a 7-coordinate geometry to four equivalent S2- and three equivalent I1- atoms. There are one shorter (2.84 Å) and three longer (2.85 Å) Nd–S bond lengths. There are a spread of Nd–I bond distances ranging from 3.26–3.47 Å. S2- is bonded to four equivalent Nd3+ atoms to form a mixture of distorted edge and corner-sharing SNd4 tetrahedra. I1- is bonded in a 3-coordinate geometry to three equivalent Nd3+ atoms.

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Materials Data on PrSI by Materials Project

PrSI crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. Pr3+ is bonded in a 7-coordinate geometry to four equivalent S2- and three equivalent I1- atoms. All Pr–S bond lengths are 2.86 Å. There are a spread of Pr–I bond distances ranging from 3.28–3.49 Å. S2- is bonded to four equivalent Pr3+ atoms to form a mixture of distorted corner and edge-sharing SPr4 tetrahedra. I1- is bonded in a 3-coordinate geometry to three equivalent Pr3+ atoms.

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Materials Data on GdSI by Materials Project

GdSI crystallizes in the hexagonal P-6 space group. The structure is three-dimensional. Gd3+ is bonded in a 2-coordinate geometry to two equivalent S2- and four equivalent I1- atoms. Both Gd–S bond lengths are 2.54 Å. There are two shorter (3.36 Å) and two longer (3.37 Å) Gd–I bond lengths. S2- is bonded in a bent 150 degrees geometry to two equivalent Gd3+ atoms. I1- is bonded in a 4-coordinate geometry to four equivalent Gd3+ atoms.

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Materials Data on La2Ti2ZnO8 by Materials Project

La2Ti2ZnO8 crystallizes in the tetragonal P-4m2 space group. The structure is three-dimensional. La3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of La–O bond distances ranging from 2.39–2.68 Å. Ti4+ is bonded to five O2- atoms to form distorted TiO5 trigonal bipyramids that share corners with two equivalent ZnO4 tetrahedra and corners with four equivalent TiO5 trigonal bipyramids. There are a spread of Ti–O bond distances ranging from 1.81–1.94 Å. Zn2+ is bonded to four equivalent O2- atoms to form distorted ZnO4 tetrahedra that share corners with four equivalent ZnO4 tetrahedra and corners with four equivalent TiO5 trigonal bipyramids. All Zn–O bond lengths are 2.06 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent La3+ and two equivalent Ti4+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent La3+ and two equivalent Ti4+ atoms. In the third O2- site, O2- is bonded in a trigonal planar geometry to one Ti4+ and two equivalent Zn2+ atoms. In the fourth O2- site, O2- is bonded in a 5-coordinate geometry to five equivalent La3+ atoms.

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Materials Data on La2Rh2I by Materials Project

La2Rh2I crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. La is bonded in a 9-coordinate geometry to six equivalent Rh and three equivalent I atoms. There are three shorter (3.14 Å) and three longer (3.16 Å) La–Rh bond lengths. All La–I bond lengths are 3.60 Å. Rh is bonded in a 9-coordinate geometry to six equivalent La and three equivalent Rh atoms. All Rh–Rh bond lengths are 2.52 Å. I is bonded in a 6-coordinate geometry to six equivalent La atoms.

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Materials Data on MgSb by Materials Project

MgSb is Tungsten Carbide structured and crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Mg2+ is bonded in a 6-coordinate geometry to six equivalent Sb2- atoms. All Mg–Sb bond lengths are 3.04 Å. Sb2- is bonded in a 6-coordinate geometry to six equivalent Mg2+ atoms.

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Materials Data on MgSn by Materials Project

MgSn is alpha-derived structured and crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Mg is bonded in a 12-coordinate geometry to six equivalent Sn atoms. All Mg–Sn bond lengths are 3.14 Å. Sn is bonded in a 12-coordinate geometry to six equivalent Mg atoms.

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Materials Data on PrPt by Materials Project

PrPt crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Pr is bonded in a 7-coordinate geometry to seven equivalent Pt atoms. There are a spread of Pr–Pt bond distances ranging from 2.97–3.15 Å. Pt is bonded in a 7-coordinate geometry to seven equivalent Pr atoms.

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Materials Data on TiNi by Materials Project

NiTi crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ti is bonded in a 7-coordinate geometry to seven equivalent Ni atoms. There are a spread of Ti–Ni bond distances ranging from 2.54–2.59 Å. Ni is bonded in a 7-coordinate geometry to seven equivalent Ti atoms.

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Materials Data on ThGeTe by Materials Project

ThGeTe crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Th is bonded in a 9-coordinate geometry to four equivalent Ge and five equivalent Te atoms. All Th–Ge bond lengths are 3.10 Å. There are four shorter (3.22 Å) and one longer (3.46 Å) Th–Te bond lengths. Ge is bonded in a distorted square co-planar geometry to four equivalent Th and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.99 Å. Te is bonded in a 5-coordinate geometry to five equivalent Th atoms.

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Materials Data on FeH4 by Materials Project

FeH4 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Fe2+ is bonded in a 9-coordinate geometry to eleven H+0.50- atoms. There are a spread of Fe–H bond distances ranging from 1.59–2.12 Å. There are three inequivalent H+0.50- sites. In the first H+0.50- site, H+0.50- is bonded in a distorted square co-planar geometry to four equivalent Fe2+ atoms. In the second H+0.50- site, H+0.50- is bonded in a distorted bent 120 degrees geometry to two equivalent Fe2+ atoms. In the third H+0.50- site, H+0.50- is bonded in a 1-coordinate geometry to three equivalent Fe2+ atoms.

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Materials Data on MgGa by Materials Project

MgGa crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Mg is bonded in a 12-coordinate geometry to seven equivalent Ga atoms. There are a spread of Mg–Ga bond distances ranging from 2.93–3.03 Å. Ga is bonded in a 9-coordinate geometry to seven equivalent Mg atoms.

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Materials Data on Cs3H12N4F3 by Materials Project

Cs3N4H12F3 crystallizes in the cubic I-43d space group. The structure is three-dimensional. Cs1+ is bonded in a 12-coordinate geometry to four equivalent N3-, twelve equivalent H1+, and four equivalent F1- atoms. All Cs–N bond lengths are 3.46 Å. There are a spread of Cs–H bond distances ranging from 3.07–3.32 Å. All Cs–F bond lengths are 3.21 Å. N3- is bonded in a trigonal non-coplanar geometry to three equivalent Cs1+ and three equivalent H1+ atoms. All N–H bond lengths are 1.03 Å. H1+ is bonded in a single-bond geometry to three equivalent Cs1+ and one N3- atom. F1- is bonded in a 4-coordinate geometry to four equivalent Cs1+ atoms.

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Materials Data on SiTc by Materials Project

TcSi is alpha-derived structured and crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Tc4+ is bonded in a 7-coordinate geometry to seven equivalent Si4- atoms. There are a spread of Tc–Si bond distances ranging from 2.41–2.69 Å. Si4- is bonded in a 7-coordinate geometry to seven equivalent Tc4+ atoms.

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Materials Data on UPdPt4 by Materials Project

UPt4Pd is beta-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. U6+ is bonded in a 12-coordinate geometry to twelve equivalent Pt2- atoms. All U–Pt bond lengths are 3.11 Å. Pt2- is bonded to three equivalent U6+, six equivalent Pt2-, and three equivalent Pd2+ atoms to form a mixture of edge, face, and corner-sharing PtU3Pd3Pt6 cuboctahedra. There are three shorter (2.64 Å) and three longer (2.66 Å) Pt–Pt bond lengths. All Pt–Pd bond lengths are 3.11 Å. Pd2+ is bonded in a 12-coordinate geometry to twelve equivalent Pt2- atoms.

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