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At least 757 records · Page 42
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DOE OSTI2020

Materials Data on TbCdNi4 by Materials Project

TbNi4Cd is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent Cd atoms. All Tb–Ni bond lengths are 2.92 Å. All Tb–Cd bond lengths are 3.05 Å. Ni is bonded to three equivalent Tb, six equivalent Ni, and three equivalent Cd atoms to form a mixture of corner, edge, and face-sharing NiTb3Cd3Ni6 cuboctahedra. There are three shorter (2.47 Å) and three longer (2.51 Å) Ni–Ni bond lengths. All Ni–Cd bond lengths are 2.91 Å. Cd is bonded in a 4-coordinate geometry to four equivalent Tb and twelve equivalent Ni atoms.

36 MATERIALS SCIENCE↗
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Materials Data on KTb2F7 by Materials Project

KTb2F7 crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are four inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of K–F bond distances ranging from 2.68–2.95 Å. In the second K1+ site, K1+ is bonded in a 5-coordinate geometry to five F1- atoms. There are a spread of K–F bond distances ranging from 2.69–2.78 Å. In the third K1+ site, K1+ is bonded in a 5-coordinate geometry to five F1- atoms. There are a spread of K–F bond distances ranging from 2.70–2.77 Å. In the fourth K1+ site, K1+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of K–F bond distances ranging from 2.70–2.96 Å. There are five inequivalent Tb3+ sites. In the first Tb3+ site, Tb3+ is bonded in a body-centered cubic geometry to eight F1- atoms. There are a spread of Tb–F bond distances ranging from 2.23–2.46 Å. In the second Tb3+ site, Tb3+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Tb–F bond distances ranging from 2.23–2.43 Å. In the third Tb3+ site, Tb3+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Tb–F bond distances ranging from 2.23–2.40 Å. In the fourth Tb3+ site, Tb3+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Tb–F bond distances ranging from 2.24–2.46 Å. In the fifth Tb3+ site, Tb3+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Tb–F bond distances ranging from 2.21–2.44 Å. There are nineteen inequivalent F1- sites. In the first F1- site, F1- is bonded to one K1+ and three Tb3+ atoms to form a mixture of distorted edge and corner-sharing FKTb3 tetrahedra. In the second F1- site, F1- is bonded to two K1+ and two Tb3+ atoms to form distorted FK2Tb2 tetrahedra that share corners with ten FK2Tb2 tetrahedra and edges with four FKTb3 tetrahedra. In the third F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one K1+ and two equivalent Tb3+ atoms. In the fourth F1- site, F1- is bonded to two K1+ and two equivalent Tb3+ atoms to form distorted FK2Tb2 tetrahedra that share corners with seven FKTb3 tetrahedra and edges with four FK2Tb2 tetrahedra. In the fifth F1- site, F1- is bonded to two K1+ and two equivalent Tb3+ atoms to form distorted FK2Tb2 tetrahedra that share corners with seven FKTb3 tetrahedra and edges with six FK2Tb2 tetrahedra. In the sixth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two Tb3+ atoms. In the seventh F1- site, F1- is bonded to two K1+ and two equivalent Tb3+ atoms to form distorted FK2Tb2 tetrahedra that share corners with seven FKTb3 tetrahedra and edges with four FK2Tb2 tetrahedra. In the eighth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two Tb3+ atoms. In the ninth F1- site, F1- is bonded to one K1+ and three Tb3+ atoms to form a mixture of distorted edge and corner-sharing FKTb3 tetrahedra. In the tenth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two Tb3+ atoms. In the eleventh F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one K1+ and two equivalent Tb3+ atoms. In the twelfth F1- site, F1- is bonded in a 4-coordinate geometry to one K1+ and three Tb3+ atoms. In the thirteenth F1- site, F1- is bonded in a 2-coordinate geometry to one K1+ and two Tb3+ atoms. In the fourteenth F1- site, F1- is bonded in a 2-coordinate geometry to one K1+ and two Tb3+ atoms. In the fifteenth F1- site, F1- is bonded to one K1+ and three Tb3+ atoms to form FKTb3 tetrahedra that share corners with six FK2Tb2 tetrahedra and edges with three FKTb3 tetrahedra. In the sixteenth F1- site, F1- is bonded to two K1+ and two equivalent Tb3+ atoms to form a mixture of distorted edge and corner-sharing FK2Tb2 tetrahedra. In the seventeenth F1- site, F1- is bonded in a 4-coordinate geometry to one K1+ and three Tb3+ atoms. In the eighteenth F1- site, F1- is bonded to two K1+ and two Tb3+ atoms to form distorted FK2Tb2 tetrahedra that share corners with ten FKTb3 tetrahedra and edges with four FK2Tb2 tetrahedra. In the nineteenth F1- site, F1- is bonded to one K1+ and three Tb3+ atoms to form a mixture of distorted edge and corner-sharing FKTb3 tetrahedra.

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Materials Data on TbGaPd2 by Materials Project

TbPd2Ga 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 eight equivalent Pd and three equivalent Ga atoms. There are a spread of Tb–Pd bond distances ranging from 3.05–3.28 Å. There are a spread of Tb–Ga bond distances ranging from 3.04–3.09 Å. Pd is bonded in a 12-coordinate geometry to four equivalent Tb and three equivalent Ga atoms. There are a spread of Pd–Ga bond distances ranging from 2.54–2.65 Å. Ga is bonded in a 9-coordinate geometry to three equivalent Tb and six equivalent Pd atoms.

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Materials Data on Tb2PdRu by Materials Project

Tb2RuPd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tb is bonded in a body-centered cubic geometry to four equivalent Ru and four equivalent Pd atoms. All Tb–Ru bond lengths are 3.00 Å. All Tb–Pd bond lengths are 3.00 Å. Ru is bonded in a body-centered cubic geometry to eight equivalent Tb atoms. Pd is bonded in a body-centered cubic geometry to eight equivalent Tb atoms.

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Materials Data on Tb2InHg by Materials Project

Tb2HgIn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tb is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent In atoms. All Tb–Hg bond lengths are 3.26 Å. All Tb–In bond lengths are 3.26 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Tb atoms. In is bonded in a body-centered cubic geometry to eight equivalent Tb atoms.

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Materials Data on Tb2InCu2 by Materials Project

Tb2Cu2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Tb is bonded in a 6-coordinate geometry to six equivalent Cu and four equivalent In atoms. There are two shorter (2.89 Å) and four longer (2.92 Å) Tb–Cu bond lengths. All Tb–In bond lengths are 3.36 Å. Cu is bonded in a 9-coordinate geometry to six equivalent Tb, one Cu, and two equivalent In atoms. The Cu–Cu bond length is 2.57 Å. Both Cu–In bond lengths are 3.05 Å. In is bonded to eight equivalent Tb and four equivalent Cu atoms to form a mixture of face and corner-sharing InTb8Cu4 cuboctahedra.

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Materials Data on TbGaFe by Materials Project

TbFeGa is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tb is bonded to six equivalent Fe and six equivalent Ga atoms to form a mixture of face and edge-sharing TbGa6Fe6 cuboctahedra. All Tb–Fe bond lengths are 3.05 Å. All Tb–Ga bond lengths are 3.05 Å. Fe is bonded in a 9-coordinate geometry to six equivalent Tb and three equivalent Ga atoms. All Fe–Ga bond lengths are 2.43 Å. Ga is bonded in a 9-coordinate geometry to six equivalent Tb and three equivalent Fe atoms.

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DOE OSTI2020

Materials Data on TbMnFe by Materials Project

TbMnFe crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to six equivalent Mn and six equivalent Fe atoms. There are four shorter (3.00 Å) and two longer (3.03 Å) Tb–Mn bond lengths. There are two shorter (3.00 Å) and four longer (3.04 Å) Tb–Fe bond lengths. Mn is bonded to six equivalent Tb, two equivalent Mn, and four equivalent Fe atoms to form MnTb6Mn2Fe4 cuboctahedra that share corners with eight equivalent FeTb6Mn4Fe2 cuboctahedra, corners with ten equivalent MnTb6Mn2Fe4 cuboctahedra, edges with six equivalent MnTb6Mn2Fe4 cuboctahedra, faces with six equivalent MnTb6Mn2Fe4 cuboctahedra, and faces with twelve equivalent FeTb6Mn4Fe2 cuboctahedra. Both Mn–Mn bond lengths are 2.61 Å. All Mn–Fe bond lengths are 2.57 Å. Fe is bonded to six equivalent Tb, four equivalent Mn, and two equivalent Fe atoms to form FeTb6Mn4Fe2 cuboctahedra that share corners with eight equivalent MnTb6Mn2Fe4 cuboctahedra, corners with ten equivalent FeTb6Mn4Fe2 cuboctahedra, edges with six equivalent FeTb6Mn4Fe2 cuboctahedra, faces with six equivalent FeTb6Mn4Fe2 cuboctahedra, and faces with twelve equivalent MnTb6Mn2Fe4 cuboctahedra. Both Fe–Fe bond lengths are 2.54 Å.

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Materials Data on Tb3Pt4 by Materials Project

Pt4Tb3 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Tb is bonded in a 9-coordinate geometry to nine Pt atoms. There are a spread of Tb–Pt bond distances ranging from 2.88–3.30 Å. There are three inequivalent Pt sites. In the first Pt site, Pt is bonded in a 6-coordinate geometry to six equivalent Tb atoms. In the second Pt site, Pt is bonded in a distorted octahedral geometry to six equivalent Tb atoms. In the third Pt site, Pt is bonded in a 10-coordinate geometry to seven equivalent Tb and three equivalent Pt atoms. There are one shorter (2.89 Å) and two longer (2.98 Å) Pt–Pt bond lengths.

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Materials Data on TbGaCo by Materials Project

TbCoGa crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Tb is bonded in a 11-coordinate geometry to five equivalent Co and six equivalent Ga atoms. There are a spread of Tb–Co bond distances ranging from 2.87–3.10 Å. There are a spread of Tb–Ga bond distances ranging from 3.02–3.11 Å. Co is bonded in a 9-coordinate geometry to five equivalent Tb and four equivalent Ga atoms. There are a spread of Co–Ga bond distances ranging from 2.51–2.59 Å. Ga is bonded in a 10-coordinate geometry to six equivalent Tb and four equivalent Co atoms.

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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↗
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Materials Data on TbZn3 by Materials Project

TbZn3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Tb is bonded in a 11-coordinate geometry to fourteen Zn atoms. There are a spread of Tb–Zn bond distances ranging from 3.00–3.46 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a 10-coordinate geometry to five equivalent Tb and five Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.58–2.78 Å. In the second Zn site, Zn is bonded in a 12-coordinate geometry to five equivalent Tb and seven Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.60–3.08 Å. In the third Zn site, Zn is bonded in a 10-coordinate geometry to four equivalent Tb and six Zn atoms.

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Materials Data on Tb2Al3Fe by Materials Project

Tb2FeAl3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to three equivalent Fe and nine equivalent Al atoms. All Tb–Fe bond lengths are 3.24 Å. There are three shorter (3.15 Å) and six longer (3.21 Å) Tb–Al bond lengths. Fe is bonded to six equivalent Tb and six equivalent Al atoms to form FeTb6Al6 cuboctahedra that share corners with six equivalent FeTb6Al6 cuboctahedra, corners with twelve equivalent AlTb6Al4Fe2 cuboctahedra, edges with six equivalent FeTb6Al6 cuboctahedra, and faces with eighteen equivalent AlTb6Al4Fe2 cuboctahedra. All Fe–Al bond lengths are 2.70 Å. Al is bonded to six equivalent Tb, two equivalent Fe, and four equivalent Al atoms to form AlTb6Al4Fe2 cuboctahedra that share corners with four equivalent FeTb6Al6 cuboctahedra, corners with fourteen equivalent AlTb6Al4Fe2 cuboctahedra, edges with six equivalent AlTb6Al4Fe2 cuboctahedra, faces with six equivalent FeTb6Al6 cuboctahedra, and faces with twelve equivalent AlTb6Al4Fe2 cuboctahedra. All Al–Al bond lengths are 2.76 Å.

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DOE OSTI2020

Materials Data on TbSbPd by Materials Project

TbPdSb crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Sb atoms. There are three shorter (2.95 Å) and three longer (3.61 Å) Tb–Pd bond lengths. There are three shorter (3.14 Å) and three longer (3.36 Å) Tb–Sb bond lengths. Pd is bonded in a 10-coordinate geometry to six equivalent Tb and four equivalent Sb atoms. There are three shorter (2.77 Å) and one longer (2.95 Å) Pd–Sb bond lengths. Sb is bonded in a 10-coordinate geometry to six equivalent Tb and four equivalent Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TbBiPt by Materials Project

TbPtBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Tb is bonded to four equivalent Pt and six equivalent Bi atoms to form a mixture of distorted corner and face-sharing TbBi6Pt4 tetrahedra. All Tb–Pt bond lengths are 2.93 Å. All Tb–Bi bond lengths are 3.38 Å. Pt is bonded in a body-centered cubic geometry to four equivalent Tb and four equivalent Bi atoms. All Pt–Bi bond lengths are 2.93 Å. Bi is bonded in a 10-coordinate geometry to six equivalent Tb and four equivalent Pt atoms.

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.

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Materials Data on Tb2AlNi2 by Materials Project

Tb2Ni2Al crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. Tb is bonded in a 10-coordinate geometry to six equivalent Ni and four equivalent Al atoms. There are two shorter (2.91 Å) and four longer (2.96 Å) Tb–Ni bond lengths. There are two shorter (3.22 Å) and two longer (3.26 Å) Tb–Al bond lengths. Ni is bonded in a 9-coordinate geometry to six equivalent Tb, one Ni, and two equivalent Al atoms. The Ni–Ni bond length is 2.48 Å. Both Ni–Al bond lengths are 2.54 Å. Al is bonded to eight equivalent Tb and four equivalent Ni atoms to form a mixture of distorted edge and face-sharing AlTb8Ni4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TbFeCu by Materials Project

TbFeCu is Hexagonal Laves-derived structured and crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to six equivalent Fe and six equivalent Cu atoms. There are four shorter (3.02 Å) and two longer (3.09 Å) Tb–Fe bond lengths. There are four shorter (2.99 Å) and two longer (3.13 Å) Tb–Cu bond lengths. Fe is bonded to six equivalent Tb, two equivalent Fe, and four equivalent Cu atoms to form FeTb6Fe2Cu4 cuboctahedra that share corners with eight equivalent CuTb6Fe4Cu2 cuboctahedra, corners with ten equivalent FeTb6Fe2Cu4 cuboctahedra, edges with six equivalent FeTb6Fe2Cu4 cuboctahedra, faces with six equivalent FeTb6Fe2Cu4 cuboctahedra, and faces with twelve equivalent CuTb6Fe4Cu2 cuboctahedra. Both Fe–Fe bond lengths are 2.54 Å. All Fe–Cu bond lengths are 2.61 Å. Cu is bonded to six equivalent Tb, four equivalent Fe, and two equivalent Cu atoms to form CuTb6Fe4Cu2 cuboctahedra that share corners with eight equivalent FeTb6Fe2Cu4 cuboctahedra, corners with ten equivalent CuTb6Fe4Cu2 cuboctahedra, edges with six equivalent CuTb6Fe4Cu2 cuboctahedra, faces with six equivalent CuTb6Fe4Cu2 cuboctahedra, and faces with twelve equivalent FeTb6Fe2Cu4 cuboctahedra. Both Cu–Cu bond lengths are 2.56 Å.

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