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At least 703 records · Page 39
All sourcesNASA NTRSDOE OSTI
DOE OSTI2020

Materials Data on Th3Hg by Materials Project

Th3Hg is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Th sites. In the first Th site, Th is bonded to eight Th and four equivalent Hg atoms to form distorted ThTh8Hg4 cuboctahedra that share corners with twelve equivalent ThTh8Hg4 cuboctahedra, edges with eight equivalent ThTh8Hg4 cuboctahedra, edges with eight equivalent HgTh12 cuboctahedra, faces with four equivalent HgTh12 cuboctahedra, and faces with ten equivalent ThTh8Hg4 cuboctahedra. There are four shorter (3.44 Å) and four longer (3.51 Å) Th–Th bond lengths. All Th–Hg bond lengths are 3.51 Å. In the second Th site, Th is bonded in a distorted square co-planar geometry to eight equivalent Th and four equivalent Hg atoms. All Th–Hg bond lengths are 3.44 Å. Hg is bonded to twelve Th atoms to form HgTh12 cuboctahedra that share corners with four equivalent HgTh12 cuboctahedra, edges with eight equivalent HgTh12 cuboctahedra, edges with sixteen equivalent ThTh8Hg4 cuboctahedra, faces with four equivalent HgTh12 cuboctahedra, and faces with eight equivalent ThTh8Hg4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiInHg2 by Materials Project

LiHg2In 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 Hg atoms. All Li–Hg bond lengths are 3.11 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent In atoms. All Hg–In bond lengths are 3.11 Å. In is bonded in a body-centered cubic geometry to eight equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on HgSO5 by Materials Project

HgSO5 crystallizes in the orthorhombic Pnma space group. The structure is two-dimensional and consists of two HgSO5 sheets oriented in the (0, 0, 1) direction. Hg is bonded in a distorted linear geometry to four O atoms. There are a spread of Hg–O bond distances ranging from 2.05–2.64 Å. S is bonded in a tetrahedral geometry to four O atoms. There are a spread of S–O bond distances ranging from 1.47–1.55 Å. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one S atom. In the second O site, O is bonded in a bent 120 degrees geometry to one Hg and one S atom. In the third O site, O is bonded in a single-bond geometry to one Hg and one S atom. In the fourth O site, O is bonded in a single-bond geometry to one Hg atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiGaHg2 by Materials Project

LiHg2Ga crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two LiHg2Ga ribbons oriented in the (0, 1, 0) direction. Li is bonded in a linear geometry to two equivalent Hg atoms. Both Li–Hg bond lengths are 2.70 Å. Hg is bonded in a linear geometry to one Li and one Ga atom. The Hg–Ga bond length is 2.84 Å. Ga is bonded in a linear geometry to two equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on ScAgHg2 by Materials Project

ScAgHg2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two ScAgHg2 ribbons oriented in the (1, 0, 0) direction. Sc is bonded in a linear geometry to two equivalent Hg atoms. Both Sc–Hg bond lengths are 2.95 Å. Ag is bonded in a linear geometry to two equivalent Hg atoms. Both Ag–Hg bond lengths are 2.78 Å. Hg is bonded in a linear geometry to one Sc and one Ag atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on AcSnHg2 by Materials Project

AcHg2Sn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ac is bonded in a distorted body-centered cubic geometry to eight equivalent Hg and six equivalent Sn atoms. All Ac–Hg bond lengths are 3.34 Å. All Ac–Sn bond lengths are 3.86 Å. Hg is bonded in a distorted body-centered cubic geometry to four equivalent Ac and four equivalent Sn atoms. All Hg–Sn bond lengths are 3.34 Å. Sn is bonded in a 8-coordinate geometry to six equivalent Ac and eight equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Li2MgHg by Materials Project

Li2MgHg crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded in a 4-coordinate geometry to four equivalent Mg atoms. All Li–Mg bond lengths are 2.91 Å. In the second Li site, Li is bonded to four equivalent Hg atoms to form distorted corner-sharing LiHg4 tetrahedra. All Li–Hg bond lengths are 2.91 Å. Mg is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Hg atoms. All Mg–Hg bond lengths are 2.91 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Mg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on HfZrHg2 by Materials Project

HfZrHg2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two HfZrHg2 ribbons oriented in the (1, 0, 0) direction. Hf is bonded in a linear geometry to two equivalent Hg atoms. Both Hf–Hg bond lengths are 2.87 Å. Zr is bonded in a linear geometry to two equivalent Hg atoms. Both Zr–Hg bond lengths are 2.88 Å. Hg is bonded in a linear geometry to one Hf and one Zr atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NaHg2Pb by Materials Project

NaHg2Pb crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two NaHg2Pb ribbons oriented in the (1, 0, 0) direction. Na is bonded in a linear geometry to two equivalent Hg atoms. Both Na–Hg bond lengths are 2.99 Å. Hg is bonded in a linear geometry to one Na and one Pb atom. The Hg–Pb bond length is 3.00 Å. Pb is bonded in a linear geometry to two equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TlHg2Bi by Materials Project

Hg2TlBi crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Hg2TlBi ribbons oriented in the (1, 0, 0) direction. Hg is bonded in a linear geometry to one Tl and one Bi atom. The Hg–Tl bond length is 3.01 Å. The Hg–Bi bond length is 2.88 Å. Tl is bonded in a linear geometry to two equivalent Hg atoms. Bi is bonded in a linear geometry to two equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiTlHg2 by Materials Project

LiHg2Tl crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two LiHg2Tl ribbons oriented in the (0, 1, 0) direction. Li is bonded in a linear geometry to two equivalent Hg atoms. Both Li–Hg bond lengths are 2.71 Å. Hg is bonded in a linear geometry to one Li and one Tl atom. The Hg–Tl bond length is 3.13 Å. Tl is bonded in a linear geometry to two equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NaMgHg2 by Materials Project

NaMgHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Na–Hg bond lengths are 3.11 Å. Mg is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Mg–Hg bond lengths are 3.11 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Mg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CdInHg2 by Materials Project

Hg2CdIn crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Hg2CdIn ribbons oriented in the (0, 1, 0) direction. Hg is bonded in a linear geometry to one Cd and one In atom. The Hg–Cd bond length is 3.13 Å. The Hg–In bond length is 3.18 Å. Cd is bonded in a linear geometry to two equivalent Hg atoms. In is bonded in a linear geometry to two equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on U3Hg by Materials Project

U3Hg is beta Cu3Ti-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded to eight U and four equivalent Hg atoms to form distorted UU8Hg4 cuboctahedra that share corners with twelve equivalent UU8Hg4 cuboctahedra, edges with eight equivalent HgU12 cuboctahedra, edges with sixteen UU8Hg4 cuboctahedra, faces with four equivalent HgU12 cuboctahedra, and faces with fourteen UU8Hg4 cuboctahedra. There are four shorter (3.12 Å) and four longer (3.18 Å) U–U bond lengths. All U–Hg bond lengths are 3.12 Å. In the second U site, U is bonded to eight equivalent U and four equivalent Hg atoms to form distorted UU8Hg4 cuboctahedra that share corners with four equivalent UU8Hg4 cuboctahedra, corners with eight equivalent HgU12 cuboctahedra, edges with twenty-four UU8Hg4 cuboctahedra, faces with six equivalent HgU12 cuboctahedra, and faces with twelve UU8Hg4 cuboctahedra. All U–Hg bond lengths are 3.18 Å. Hg is bonded to twelve U atoms to form HgU12 cuboctahedra that share corners with four equivalent HgU12 cuboctahedra, corners with eight equivalent UU8Hg4 cuboctahedra, edges with eight equivalent HgU12 cuboctahedra, edges with sixteen equivalent UU8Hg4 cuboctahedra, faces with four equivalent HgU12 cuboctahedra, and faces with fourteen UU8Hg4 cuboctahedra.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on YbYHg2 by Materials Project

YbYHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Yb is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Yb–Hg bond lengths are 3.23 Å. Y is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Y–Hg bond lengths are 3.23 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Y atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on TlInHg2 by Materials Project

Hg2TlIn crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Hg2TlIn ribbons oriented in the (1, 0, 0) direction. Hg is bonded in a linear geometry to one Tl and one In atom. The Hg–Tl bond length is 3.11 Å. The Hg–In bond length is 3.03 Å. Tl is bonded in a linear geometry to two equivalent Hg atoms. In is bonded in a linear geometry to two equivalent Hg atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on NaHg2Pd by Materials Project

NaPdHg2 crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two NaPdHg2 ribbons oriented in the (1, 0, 0) direction. Na is bonded in a linear geometry to two equivalent Hg atoms. Both Na–Hg bond lengths are 2.99 Å. Pd is bonded in a linear geometry to two equivalent Hg atoms. Both Pd–Hg bond lengths are 2.65 Å. Hg is bonded in a linear geometry to one Na and one Pd atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LuAgHg2 by Materials Project

LuAgHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Lu is bonded in a distorted body-centered cubic geometry to six equivalent Ag and eight equivalent Hg atoms. All Lu–Ag bond lengths are 3.51 Å. All Lu–Hg bond lengths are 3.04 Å. Ag is bonded in a 8-coordinate geometry to six equivalent Lu and eight equivalent Hg atoms. All Ag–Hg bond lengths are 3.04 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Lu and four equivalent Ag atoms.

36 MATERIALS SCIENCE↗