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At least 1,693 records · Page 94
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DOE OSTI2020

Materials Data on La2MgCd by Materials Project

MgLa2Cd 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 La atoms. All Mg–La bond lengths are 3.42 Å. La is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Cd atoms. All La–Cd bond lengths are 3.42 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent La atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdCSBr2N3O by Materials Project

CdCNSOBr2N2 crystallizes in the monoclinic Cc space group. The structure is three-dimensional and consists of four nitrogen molecules and one CdCNSOBr2 framework. In the CdCNSOBr2 framework, Cd2+ is bonded to one N, one S2-, and three Br1- atoms to form distorted corner-sharing CdSBr3N trigonal bipyramids. The Cd–N bond length is 2.33 Å. The Cd–S bond length is 2.92 Å. There are a spread of Cd–Br bond distances ranging from 2.67–2.75 Å. C4+ is bonded in a distorted linear geometry to one N and one S2- atom. The C–N bond length is 1.18 Å. The C–S bond length is 1.63 Å. N is bonded in a bent 150 degrees geometry to one Cd2+ and one C4+ atom. S2- is bonded in a distorted trigonal non-coplanar geometry to one Cd2+, one C4+, and one O2- atom. The S–O bond length is 2.37 Å. O2- is bonded in a distorted trigonal non-coplanar geometry to one S2- and two equivalent Br1- atoms. There are one shorter (2.47 Å) and one longer (2.48 Å) O–Br bond lengths. There are two inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a water-like geometry to two equivalent Cd2+ atoms. In the second Br1- site, Br1- is bonded in a distorted trigonal non-coplanar geometry to one Cd2+ and two equivalent O2- atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ba2LiCd by Materials Project

LiBa2Cd crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two LiBa2Cd ribbons oriented in the (0, 1, 0) direction. Li is bonded in a linear geometry to two equivalent Ba atoms. Both Li–Ba bond lengths are 3.73 Å. Ba is bonded in a linear geometry to one Li and one Cd atom. The Ba–Cd bond length is 3.51 Å. Cd is bonded in a linear geometry to two equivalent Ba atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li2CdBi by Materials Project

Li2CdBi 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 four equivalent Cd and four equivalent Bi atoms. All Li–Cd bond lengths are 3.01 Å. All Li–Bi bond lengths are 3.01 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Li atoms. Bi is bonded in a body-centered cubic geometry to eight equivalent Li atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pr2CdHg by Materials Project

Pr2HgCd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pr is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent Cd atoms. All Pr–Hg bond lengths are 3.36 Å. All Pr–Cd bond lengths are 3.36 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Pr atoms. Cd is bonded in a body-centered cubic geometry to eight equivalent Pr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TiCdRh2 by Materials Project

TiRh2Cd crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two TiRh2Cd ribbons oriented in the (1, 0, 0) direction. Ti is bonded in a linear geometry to two equivalent Rh atoms. Both Ti–Rh bond lengths are 2.07 Å. Rh is bonded in a linear geometry to one Ti and one Cd atom. The Rh–Cd bond length is 2.78 Å. Cd is bonded in a linear geometry to two equivalent Rh atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pm2CdPb by Materials Project

Pm2CdPb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pm is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Pb atoms. All Pm–Cd bond lengths are 3.35 Å. All Pm–Pb bond lengths are 3.35 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Pm atoms. Pb is bonded in a body-centered cubic geometry to eight equivalent Pm atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ca2MgCd by Materials Project

Ca2MgCd 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 Mg and four equivalent Cd atoms. All Ca–Mg bond lengths are 3.38 Å. All Ca–Cd bond lengths are 3.38 Å. Mg is bonded in a body-centered cubic geometry to eight equivalent Ca atoms. Cd is bonded in a body-centered cubic geometry to eight equivalent Ca atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Lu3Cd by Materials Project

Lu3Cd is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Lu is bonded to eight equivalent Lu and four equivalent Cd atoms to form distorted LuLu8Cd4 cuboctahedra that share corners with twelve equivalent LuLu8Cd4 cuboctahedra, edges with eight equivalent CdLu12 cuboctahedra, edges with sixteen equivalent LuLu8Cd4 cuboctahedra, faces with four equivalent CdLu12 cuboctahedra, and faces with fourteen equivalent LuLu8Cd4 cuboctahedra. All Lu–Lu bond lengths are 3.37 Å. All Lu–Cd bond lengths are 3.37 Å. Cd is bonded to twelve equivalent Lu atoms to form CdLu12 cuboctahedra that share corners with twelve equivalent CdLu12 cuboctahedra, edges with twenty-four equivalent LuLu8Cd4 cuboctahedra, faces with six equivalent CdLu12 cuboctahedra, and faces with twelve equivalent LuLu8Cd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on MgCd by Materials Project

MgCd is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded to six equivalent Cd atoms to form a mixture of edge and corner-sharing MgCd6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Mg–Cd bond lengths are 2.97 Å. Cd is bonded to six equivalent Mg atoms to form a mixture of edge and corner-sharing CdMg6 octahedra. The corner-sharing octahedral tilt angles are 0°.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Gd3Cd by Materials Project

Gd3Cd is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Gd is bonded to eight equivalent Gd and four equivalent Cd atoms to form distorted GdGd8Cd4 cuboctahedra that share corners with four equivalent CdGd12 cuboctahedra, corners with fourteen equivalent GdGd8Cd4 cuboctahedra, edges with six equivalent CdGd12 cuboctahedra, edges with twelve equivalent GdGd8Cd4 cuboctahedra, faces with four equivalent CdGd12 cuboctahedra, and faces with sixteen equivalent GdGd8Cd4 cuboctahedra. There are a spread of Gd–Gd bond distances ranging from 3.38–3.62 Å. There are two shorter (3.39 Å) and two longer (3.50 Å) Gd–Cd bond lengths. Cd is bonded to twelve equivalent Gd atoms to form CdGd12 cuboctahedra that share corners with six equivalent CdGd12 cuboctahedra, corners with twelve equivalent GdGd8Cd4 cuboctahedra, edges with eighteen equivalent GdGd8Cd4 cuboctahedra, faces with eight equivalent CdGd12 cuboctahedra, and faces with twelve equivalent GdGd8Cd4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Y2CdAg by Materials Project

Y2AgCd crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Y2AgCd ribbons oriented in the (1, 0, 0) direction. Y is bonded in a linear geometry to one Ag and one Cd atom. The Y–Ag bond length is 2.97 Å. The Y–Cd bond length is 3.13 Å. Ag is bonded in a linear geometry to two equivalent Y atoms. Cd is bonded in a linear geometry to two equivalent Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Sc2CdAu by Materials Project

Sc2AuCd 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 four equivalent Au and four equivalent Cd atoms. All Sc–Au bond lengths are 3.01 Å. All Sc–Cd bond lengths are 3.01 Å. Au is bonded in a body-centered cubic geometry to eight equivalent Sc atoms. Cd is bonded in a body-centered cubic geometry to eight equivalent Sc atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pr2MgCd by Materials Project

MgPr2Cd 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 Pr atoms. All Mg–Pr bond lengths are 3.37 Å. Pr is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Cd atoms. All Pr–Cd bond lengths are 3.37 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Pr atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Pm2CdHg by Materials Project

Pm2HgCd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pm is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent Cd atoms. All Pm–Hg bond lengths are 3.31 Å. All Pm–Cd bond lengths are 3.31 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Pm atoms. Cd is bonded in a body-centered cubic geometry to eight equivalent Pm atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li2CdAg by Materials Project

Li2AgCd 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 four equivalent Ag and four equivalent Cd atoms. All Li–Ag bond lengths are 2.82 Å. All Li–Cd bond lengths are 2.82 Å. Ag is bonded in a body-centered cubic geometry to eight equivalent Li atoms. Cd is bonded in a body-centered cubic geometry to eight equivalent Li atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NaV4Cd3O12 by Materials Project

NaV4Cd3O12 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic Pm space group. The structure is three-dimensional. Na1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Na–O bond distances ranging from 2.36–2.67 Å. There are two inequivalent V+4.25+ sites. In the first V+4.25+ site, V+4.25+ is bonded to six O2- atoms to form corner-sharing VO6 octahedra. The corner-sharing octahedra tilt angles range from 23–30°. There are a spread of V–O bond distances ranging from 1.88–2.01 Å. In the second V+4.25+ site, V+4.25+ is bonded to six O2- atoms to form corner-sharing VO6 octahedra. The corner-sharing octahedra tilt angles range from 23–30°. There are a spread of V–O bond distances ranging from 1.88–2.03 Å. There are three inequivalent Cd2+ sites. In the first Cd2+ site, Cd2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Cd–O bond distances ranging from 2.25–2.66 Å. In the second Cd2+ site, Cd2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Cd–O bond distances ranging from 2.27–2.67 Å. In the third Cd2+ site, Cd2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Cd–O bond distances ranging from 2.28–2.67 Å. There are eight inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to one Na1+, two V+4.25+, and two Cd2+ atoms. In the second O2- site, O2- is bonded in a 5-coordinate geometry to one Na1+, two V+4.25+, and two Cd2+ atoms. In the third O2- site, O2- is bonded in a 5-coordinate geometry to two V+4.25+ and three Cd2+ atoms. In the fourth O2- site, O2- is bonded in a 5-coordinate geometry to one Na1+, two V+4.25+, and two Cd2+ atoms. In the fifth O2- site, O2- is bonded in a 4-coordinate geometry to one Na1+, two equivalent V+4.25+, and one Cd2+ atom. In the sixth O2- site, O2- is bonded in a 4-coordinate geometry to one Na1+, two equivalent V+4.25+, and one Cd2+ atom. In the seventh O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent V+4.25+ and two Cd2+ atoms. In the eighth O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent V+4.25+ and two Cd2+ atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ce2CdPb by Materials Project

Ce2CdPb 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 four equivalent Cd and four equivalent Pb atoms. All Ce–Cd bond lengths are 3.38 Å. All Ce–Pb bond lengths are 3.38 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Ce atoms. Pb is bonded in a body-centered cubic geometry to eight equivalent Ce atoms.

36 MATERIALS SCIENCE↗