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At least 955 records · Page 53
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DOE OSTI2020

Materials Data on Lu2TlCd by Materials Project

Lu2CdTl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Lu is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Tl atoms. All Lu–Cd bond lengths are 3.21 Å. All Lu–Tl bond lengths are 3.21 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Lu atoms. Tl is bonded in a body-centered cubic geometry to eight equivalent Lu atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TlCdRh2 by Materials Project

Rh2CdTl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Rh is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Tl atoms. All Rh–Cd bond lengths are 2.83 Å. All Rh–Tl bond lengths are 2.83 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. Tl is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ba2TlCd by Materials Project

Ba2CdTl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ba is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Tl atoms. All Ba–Cd bond lengths are 3.71 Å. All Ba–Tl bond lengths are 3.71 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Ba atoms. Tl is bonded in a body-centered cubic geometry to eight equivalent Ba atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Gd2TlCd by Materials Project

Gd2CdTl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Gd is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Tl atoms. All Gd–Cd bond lengths are 3.54 Å. All Gd–Tl bond lengths are 3.54 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Gd atoms. Tl is bonded in a body-centered cubic geometry to eight equivalent Gd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiCa2Tl by Materials Project

LiCa2Tl 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 Ca atoms. All Li–Ca bond lengths are 3.35 Å. Ca is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Tl atoms. All Ca–Tl bond lengths are 3.35 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Ca atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Sm2TlCd by Materials Project

Sm2CdTl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sm is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Tl atoms. All Sm–Cd bond lengths are 3.33 Å. All Sm–Tl bond lengths are 3.33 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Sm atoms. Tl is bonded in a body-centered cubic geometry to eight equivalent Sm atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pm3Tl by Materials Project

Pm3Tl is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pm is bonded to eight equivalent Pm and four equivalent Tl atoms to form distorted PmPm8Tl4 cuboctahedra that share corners with twelve equivalent PmPm8Tl4 cuboctahedra, edges with eight equivalent TlPm12 cuboctahedra, edges with sixteen equivalent PmPm8Tl4 cuboctahedra, faces with four equivalent TlPm12 cuboctahedra, and faces with fourteen equivalent PmPm8Tl4 cuboctahedra. All Pm–Pm bond lengths are 3.51 Å. All Pm–Tl bond lengths are 3.51 Å. Tl is bonded to twelve equivalent Pm atoms to form TlPm12 cuboctahedra that share corners with twelve equivalent TlPm12 cuboctahedra, edges with twenty-four equivalent PmPm8Tl4 cuboctahedra, faces with six equivalent TlPm12 cuboctahedra, and faces with twelve equivalent PmPm8Tl4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CeTlAg2 by Materials Project

CeAg2Tl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ce is bonded in a body-centered cubic geometry to eight equivalent Ag atoms. All Ce–Ag bond lengths are 3.13 Å. Ag is bonded in a body-centered cubic geometry to four equivalent Ce and four equivalent Tl atoms. All Ag–Tl bond lengths are 3.13 Å. Tl is bonded in a distorted body-centered cubic geometry to eight equivalent Ag atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Eu3Tl by Materials Project

Eu3Tl is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Eu is bonded to eight equivalent Eu and four equivalent Tl atoms to form distorted EuEu8Tl4 cuboctahedra that share corners with four equivalent TlEu12 cuboctahedra, corners with fourteen equivalent EuEu8Tl4 cuboctahedra, edges with six equivalent TlEu12 cuboctahedra, edges with twelve equivalent EuEu8Tl4 cuboctahedra, faces with four equivalent TlEu12 cuboctahedra, and faces with sixteen equivalent EuEu8Tl4 cuboctahedra. There are a spread of Eu–Eu bond distances ranging from 3.51–3.90 Å. There are two shorter (3.52 Å) and two longer (3.70 Å) Eu–Tl bond lengths. Tl is bonded to twelve equivalent Eu atoms to form TlEu12 cuboctahedra that share corners with six equivalent TlEu12 cuboctahedra, corners with twelve equivalent EuEu8Tl4 cuboctahedra, edges with eighteen equivalent EuEu8Tl4 cuboctahedra, faces with eight equivalent TlEu12 cuboctahedra, and faces with twelve equivalent EuEu8Tl4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Dy2MgTl by Materials Project

MgDy2Tl 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 Dy atoms. All Mg–Dy bond lengths are 3.27 Å. Dy is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Tl atoms. All Dy–Tl bond lengths are 3.27 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Dy atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CeTlAu2 by Materials Project

CeAu2Tl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ce is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Ce–Au bond lengths are 3.13 Å. Au is bonded in a body-centered cubic geometry to four equivalent Ce and four equivalent Tl atoms. All Au–Tl bond lengths are 3.13 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Au atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LaTlAu2 by Materials Project

LaAu2Tl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. La is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All La–Au bond lengths are 3.18 Å. Au is bonded in a body-centered cubic geometry to four equivalent La and four equivalent Tl atoms. All Au–Tl bond lengths are 3.18 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Au atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LaTlAg2 by Materials Project

LaAg2Tl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. La is bonded in a body-centered cubic geometry to eight equivalent Ag atoms. All La–Ag bond lengths are 3.17 Å. Ag is bonded in a body-centered cubic geometry to four equivalent La and four equivalent Tl atoms. All Ag–Tl bond lengths are 3.17 Å. Tl is bonded in a distorted body-centered cubic geometry to eight equivalent Ag atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ca2TlCd by Materials Project

Ca2CdTl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Tl atoms. All Ca–Cd bond lengths are 3.35 Å. All Ca–Tl bond lengths are 3.35 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Ca atoms. Tl is bonded in a body-centered cubic geometry to eight equivalent Ca atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on La2TlCd by Materials Project

La2CdTl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. La is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Tl atoms. All La–Cd bond lengths are 3.44 Å. All La–Tl bond lengths are 3.44 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent La atoms. Tl is bonded in a body-centered cubic geometry to eight equivalent La atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ScTlRh2 by Materials Project

ScRh2Tl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sc is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Sc–Rh bond lengths are 2.82 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Sc and four equivalent Tl atoms. All Rh–Tl bond lengths are 2.82 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiTl by Materials Project

LiTl is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Li–Tl bond lengths are 3.01 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Li atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tl2PAuS4 by Materials Project

AuTl2PS4 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Au1+ is bonded in a 2-coordinate geometry to two equivalent Tl1+ and two equivalent S2- atoms. Both Au–Tl bond lengths are 3.68 Å. Both Au–S bond lengths are 2.33 Å. There are two inequivalent Tl1+ sites. In the first Tl1+ site, Tl1+ is bonded in a 9-coordinate geometry to nine S2- atoms. There are a spread of Tl–S bond distances ranging from 3.23–3.57 Å. In the second Tl1+ site, Tl1+ is bonded to two equivalent Au1+ and six S2- atoms to form distorted TlAu2S6 hexagonal bipyramids that share corners with four equivalent TlAu2S6 hexagonal bipyramids, corners with two equivalent PS4 tetrahedra, edges with two equivalent TlAu2S6 hexagonal bipyramids, and edges with two equivalent PS4 tetrahedra. There are a spread of Tl–S bond distances ranging from 3.08–3.72 Å. P5+ is bonded to four S2- atoms to form PS4 tetrahedra that share corners with two equivalent TlAu2S6 hexagonal bipyramids and edges with two equivalent TlAu2S6 hexagonal bipyramids. There are a spread of P–S bond distances ranging from 2.02–2.10 Å. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 1-coordinate geometry to five Tl1+ and one P5+ atom. In the second S2- site, S2- is bonded in a 5-coordinate geometry to four Tl1+ and one P5+ atom. In the third S2- site, S2- is bonded in a 1-coordinate geometry to one Au1+, three Tl1+, and one P5+ atom.

36 MATERIALS SCIENCE↗