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At least 919 records · Page 51
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DOE OSTI2020

Materials Data on Eu3Th by Materials Project

ThEu3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Th is bonded to twelve equivalent Eu atoms to form ThEu12 cuboctahedra that share corners with twelve equivalent ThEu12 cuboctahedra, edges with twenty-four equivalent EuEu8Th4 cuboctahedra, faces with six equivalent ThEu12 cuboctahedra, and faces with twelve equivalent EuEu8Th4 cuboctahedra. All Th–Eu bond lengths are 3.80 Å. Eu is bonded to four equivalent Th and eight equivalent Eu atoms to form EuEu8Th4 cuboctahedra that share corners with twelve equivalent EuEu8Th4 cuboctahedra, edges with eight equivalent ThEu12 cuboctahedra, edges with sixteen equivalent EuEu8Th4 cuboctahedra, faces with four equivalent ThEu12 cuboctahedra, and faces with fourteen equivalent EuEu8Th4 cuboctahedra. All Eu–Eu bond lengths are 3.80 Å.

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Materials Data on ThBi3 by Materials Project

ThBi3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Th is bonded to twelve equivalent Bi atoms to form ThBi12 cuboctahedra that share corners with twelve equivalent ThBi12 cuboctahedra, edges with twenty-four equivalent BiTh4Bi8 cuboctahedra, faces with six equivalent ThBi12 cuboctahedra, and faces with twelve equivalent BiTh4Bi8 cuboctahedra. All Th–Bi bond lengths are 3.51 Å. Bi is bonded to four equivalent Th and eight equivalent Bi atoms to form distorted BiTh4Bi8 cuboctahedra that share corners with twelve equivalent BiTh4Bi8 cuboctahedra, edges with eight equivalent ThBi12 cuboctahedra, edges with sixteen equivalent BiTh4Bi8 cuboctahedra, faces with four equivalent ThBi12 cuboctahedra, and faces with fourteen equivalent BiTh4Bi8 cuboctahedra. All Bi–Bi bond lengths are 3.51 Å.

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DOE OSTI2020

Materials Data on ThInRu2 by Materials Project

ThRu2In is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Th is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Th–Ru bond lengths are 2.94 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Th and four equivalent In atoms. All Ru–In bond lengths are 2.94 Å. In is bonded in a distorted body-centered cubic geometry to eight equivalent Ru atoms.

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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.

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Materials Data on ThCdPd2 by Materials Project

ThPd2Cd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Th is bonded in a body-centered cubic geometry to eight equivalent Pd atoms. All Th–Pd bond lengths are 3.02 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Th and four equivalent Cd atoms. All Pd–Cd bond lengths are 3.02 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Pd atoms.

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Materials Data on ErThRu2 by Materials Project

ThErRu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Th is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Th–Ru bond lengths are 3.01 Å. Er is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Er–Ru bond lengths are 3.01 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Th and four equivalent Er atoms.

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Materials Data on ThZnAu2 by Materials Project

ThAu2Zn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Th is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Th–Au bond lengths are 3.05 Å. Au is bonded in a body-centered cubic geometry to four equivalent Th and four equivalent Zn atoms. All Au–Zn bond lengths are 3.05 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Au atoms.

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Materials Data on ThPa3 by Materials Project

Pa3Th is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pa is bonded to eight equivalent Pa and four equivalent Th atoms to form PaTh4Pa8 cuboctahedra that share corners with twelve equivalent PaTh4Pa8 cuboctahedra, edges with eight equivalent ThPa12 cuboctahedra, edges with sixteen equivalent PaTh4Pa8 cuboctahedra, faces with four equivalent ThPa12 cuboctahedra, and faces with fourteen equivalent PaTh4Pa8 cuboctahedra. All Pa–Pa bond lengths are 3.35 Å. All Pa–Th bond lengths are 3.35 Å. Th is bonded to twelve equivalent Pa atoms to form ThPa12 cuboctahedra that share corners with twelve equivalent ThPa12 cuboctahedra, edges with twenty-four equivalent PaTh4Pa8 cuboctahedra, faces with six equivalent ThPa12 cuboctahedra, and faces with twelve equivalent PaTh4Pa8 cuboctahedra.

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Materials Data on ThPt3 by Materials Project

ThPt3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Th is bonded to twelve equivalent Pt atoms to form a mixture of corner and face-sharing ThPt12 cuboctahedra. All Th–Pt bond lengths are 3.00 Å. Pt is bonded in a distorted square co-planar geometry to four equivalent Th atoms.

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Materials Data on GdThN2 by Materials Project

ThGdN2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Th is bonded to six equivalent N atoms to form ThN6 octahedra that share corners with six equivalent GdN6 octahedra, edges with six equivalent ThN6 octahedra, and edges with six equivalent GdN6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Th–N bond lengths are 2.55 Å. Gd is bonded to six equivalent N atoms to form GdN6 octahedra that share corners with six equivalent ThN6 octahedra, edges with six equivalent ThN6 octahedra, and edges with six equivalent GdN6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Gd–N bond lengths are 2.55 Å. N is bonded to three equivalent Th and three equivalent Gd atoms to form a mixture of edge and corner-sharing NGd3Th3 octahedra. The corner-sharing octahedral tilt angles are 0°.

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Materials Data on Tb3Th by Materials Project

ThTb3 is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Th is bonded to twelve equivalent Tb atoms to form ThTb12 cuboctahedra that share corners with six equivalent ThTb12 cuboctahedra, corners with twelve equivalent TbTb8Th4 cuboctahedra, edges with eighteen equivalent TbTb8Th4 cuboctahedra, faces with eight equivalent ThTb12 cuboctahedra, and faces with twelve equivalent TbTb8Th4 cuboctahedra. There are six shorter (3.57 Å) and six longer (3.58 Å) Th–Tb bond lengths. Tb is bonded to four equivalent Th and eight equivalent Tb atoms to form TbTb8Th4 cuboctahedra that share corners with four equivalent ThTb12 cuboctahedra, corners with fourteen equivalent TbTb8Th4 cuboctahedra, edges with six equivalent ThTb12 cuboctahedra, edges with twelve equivalent TbTb8Th4 cuboctahedra, faces with four equivalent ThTb12 cuboctahedra, and faces with sixteen equivalent TbTb8Th4 cuboctahedra. There are a spread of Tb–Tb bond distances ranging from 3.56–3.59 Å.

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Materials Data on ThBO3 by Materials Project

ThBO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Th is bonded to twelve equivalent O atoms to form ThO12 cuboctahedra that share corners with twelve equivalent ThO12 cuboctahedra, faces with six equivalent ThO12 cuboctahedra, and faces with eight equivalent BO6 octahedra. All Th–O bond lengths are 2.60 Å. B is bonded to six equivalent O atoms to form BO6 octahedra that share corners with six equivalent BO6 octahedra and faces with eight equivalent ThO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All B–O bond lengths are 1.84 Å. O is bonded to four equivalent Th and two equivalent B atoms to form a mixture of distorted corner, edge, and face-sharing OTh4B2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.

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Materials Data on ThCl by Materials Project

ThCl crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Th is bonded in a 4-coordinate geometry to four equivalent Cl atoms. There are one shorter (2.89 Å) and three longer (3.00 Å) Th–Cl bond lengths. Cl is bonded in a 4-coordinate geometry to four equivalent Th atoms.

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DOE OSTI2020

Materials Data on ThUBe26 by Materials Project

Be26UTh crystallizes in the cubic F432 space group. The structure is three-dimensional. there are two inequivalent Be sites. In the first Be site, Be is bonded to ten Be, one U, and one Th atom to form a mixture of distorted edge, face, and corner-sharing BeThUBe10 cuboctahedra. There are a spread of Be–Be bond distances ranging from 2.15–2.35 Å. The Be–U bond length is 2.99 Å. The Be–Th bond length is 3.03 Å. In the second Be site, Be is bonded to twelve equivalent Be atoms to form a mixture of face and corner-sharing BeBe12 cuboctahedra. U is bonded in a 1-coordinate geometry to twenty-four equivalent Be atoms. Th is bonded in a 1-coordinate geometry to twenty-four equivalent Be atoms.

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DOE OSTI2020

Materials Data on HoThRu2 by Materials Project

ThHoRu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Th is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Th–Ru bond lengths are 3.01 Å. Ho is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Ho–Ru bond lengths are 3.01 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Th and four equivalent Ho atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Th3Pb by Materials Project

Th3Pb is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Th is bonded in a distorted square co-planar geometry to four equivalent Pb atoms. All Th–Pb bond lengths are 3.53 Å. Pb is bonded to twelve equivalent Th atoms to form a mixture of face and corner-sharing PbTh12 cuboctahedra.

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DOE OSTI2020

Materials Data on Ba3Th by Materials Project

Ba3Th is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ba is bonded to eight equivalent Ba and four equivalent Th atoms to form distorted BaBa8Th4 cuboctahedra that share corners with four equivalent ThBa12 cuboctahedra, corners with fourteen equivalent BaBa8Th4 cuboctahedra, edges with six equivalent ThBa12 cuboctahedra, edges with twelve equivalent BaBa8Th4 cuboctahedra, faces with four equivalent ThBa12 cuboctahedra, and faces with sixteen equivalent BaBa8Th4 cuboctahedra. There are a spread of Ba–Ba bond distances ranging from 3.99–4.45 Å. There are two shorter (3.99 Å) and two longer (4.22 Å) Ba–Th bond lengths. Th is bonded to twelve equivalent Ba atoms to form ThBa12 cuboctahedra that share corners with six equivalent ThBa12 cuboctahedra, corners with twelve equivalent BaBa8Th4 cuboctahedra, edges with eighteen equivalent BaBa8Th4 cuboctahedra, faces with eight equivalent ThBa12 cuboctahedra, and faces with twelve equivalent BaBa8Th4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ThMgRh2 by Materials Project

MgThRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Mg–Rh bond lengths are 2.94 Å. Th is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Th–Rh bond lengths are 2.94 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Th atoms.

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