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At least 1,351 records · Page 75
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DOE OSTI2020

Materials Data on LiYb2InGe2 by Materials Project

LiYb2InGe2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li is bonded in a 12-coordinate geometry to two equivalent Yb, one In, and four Ge atoms. Both Li–Yb bond lengths are 3.39 Å. The Li–In bond length is 2.92 Å. There are a spread of Li–Ge bond distances ranging from 2.67–2.80 Å. There are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a 5-coordinate geometry to two equivalent Li, four equivalent In, and five Ge atoms. There are two shorter (3.28 Å) and two longer (3.44 Å) Yb–In bond lengths. There are a spread of Yb–Ge bond distances ranging from 3.06–3.12 Å. In the second Yb site, Yb is bonded in a 5-coordinate geometry to three equivalent In and five Ge atoms. There are two shorter (3.50 Å) and one longer (3.59 Å) Yb–In bond lengths. There are a spread of Yb–Ge bond distances ranging from 3.06–3.13 Å. In is bonded in a 12-coordinate geometry to one Li, seven Yb, and four Ge atoms. There are a spread of In–Ge bond distances ranging from 2.80–2.84 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to one Li, six Yb, and two equivalent In atoms. In the second Ge site, Ge is bonded in a 9-coordinate geometry to three equivalent Li, four Yb, and two equivalent In atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on SrGe3Pd by Materials Project

SrPdGe3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Sr is bonded in a 12-coordinate geometry to four equivalent Pd and twelve Ge atoms. All Sr–Pd bond lengths are 3.51 Å. There are a spread of Sr–Ge bond distances ranging from 3.36–3.48 Å. Pd is bonded in a 5-coordinate geometry to four equivalent Sr and five Ge atoms. There are one shorter (2.51 Å) and four longer (2.54 Å) Pd–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 1-coordinate geometry to four equivalent Sr, one Pd, and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.72 Å. In the second Ge site, Ge is bonded in a 2-coordinate geometry to four equivalent Sr, two equivalent Pd, and two equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on CeGaGe by Materials Project

CeGeGa is hexagonal omega structure-derived structured and crystallizes in the tetragonal I4_1md space group. The structure is three-dimensional. there are three inequivalent Ce sites. In the first Ce site, Ce is bonded to six equivalent Ga and six equivalent Ge atoms to form a mixture of edge and face-sharing CeGa6Ge6 cuboctahedra. There are two shorter (3.24 Å) and four longer (3.25 Å) Ce–Ga bond lengths. All Ce–Ge bond lengths are 3.25 Å. In the second Ce site, Ce is bonded to six Ga and six equivalent Ge atoms to form a mixture of edge and face-sharing CeGa6Ge6 cuboctahedra. There are two shorter (3.24 Å) and four longer (3.25 Å) Ce–Ga bond lengths. All Ce–Ge bond lengths are 3.25 Å. In the third Ce site, Ce is bonded to six Ga and six equivalent Ge atoms to form a mixture of edge and face-sharing CeGa6Ge6 cuboctahedra. There are two shorter (3.24 Å) and four longer (3.25 Å) Ce–Ga bond lengths. All Ce–Ge bond lengths are 3.25 Å. There are three inequivalent Ga sites. In the first Ga site, Ga is bonded in a 3-coordinate geometry to six Ce and three equivalent Ge atoms. There are one shorter (2.45 Å) and two longer (2.46 Å) Ga–Ge bond lengths. In the second Ga site, Ga is bonded in a 3-coordinate geometry to six Ce and three equivalent Ge atoms. Both Ga–Ce bond lengths are 3.24 Å. There are one shorter (2.45 Å) and two longer (2.46 Å) Ga–Ge bond lengths. In the third Ga site, Ga is bonded in a 3-coordinate geometry to six Ce and three equivalent Ge atoms. All Ga–Ce bond lengths are 3.25 Å. There are one shorter (2.45 Å) and two longer (2.46 Å) Ga–Ge bond lengths. Ge is bonded in a 3-coordinate geometry to six Ce and three Ga atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ho3Ge13Rh4 by Materials Project

Ho3Rh4Ge13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Ho is bonded in a 8-coordinate geometry to four equivalent Rh and twelve equivalent Ge atoms. All Ho–Rh bond lengths are 3.20 Å. There are eight shorter (3.14 Å) and four longer (3.23 Å) Ho–Ge bond lengths. Rh is bonded in a 6-coordinate geometry to three equivalent Ho and six equivalent Ge atoms. All Rh–Ge bond lengths are 2.50 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 2-coordinate geometry to three equivalent Ho, two equivalent Rh, and one Ge atom. The Ge–Ge bond length is 3.11 Å. In the second Ge site, Ge is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on MgGe3 by Materials Project

MgGe3 is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Mg is bonded to twelve Ge atoms to form MgGe12 cuboctahedra that share corners with four equivalent MgGe12 cuboctahedra, edges with eight equivalent MgGe12 cuboctahedra, edges with sixteen equivalent GeMg4Ge8 cuboctahedra, faces with four equivalent MgGe12 cuboctahedra, and faces with eight equivalent GeMg4Ge8 cuboctahedra. There are four shorter (2.96 Å) and eight longer (3.06 Å) Mg–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a square co-planar geometry to four equivalent Mg and eight equivalent Ge atoms. All Ge–Ge bond lengths are 3.06 Å. In the second Ge site, Ge is bonded to four equivalent Mg and eight Ge atoms to form distorted GeMg4Ge8 cuboctahedra that share corners with twelve equivalent GeMg4Ge8 cuboctahedra, edges with eight equivalent MgGe12 cuboctahedra, edges with eight equivalent GeMg4Ge8 cuboctahedra, faces with four equivalent MgGe12 cuboctahedra, and faces with ten equivalent GeMg4Ge8 cuboctahedra. All Ge–Ge bond lengths are 2.96 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tm3Ge13Ru4 by Materials Project

Tm3Ru4Ge13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Tm is bonded in a 8-coordinate geometry to four equivalent Ru and twelve equivalent Ge atoms. All Tm–Ru bond lengths are 3.19 Å. There are eight shorter (3.15 Å) and four longer (3.21 Å) Tm–Ge bond lengths. Ru is bonded in a 6-coordinate geometry to three equivalent Tm and six equivalent Ge atoms. All Ru–Ge bond lengths are 2.49 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 2-coordinate geometry to three equivalent Tm, two equivalent Ru, and two Ge atoms. There are one shorter (2.67 Å) and one longer (3.07 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on LiSmGe2 by Materials Project

LiSmGe2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li is bonded in a 5-coordinate geometry to five Ge atoms. There are a spread of Li–Ge bond distances ranging from 2.54–2.74 Å. Sm is bonded in a 6-coordinate geometry to nine Ge atoms. There are a spread of Sm–Ge bond distances ranging from 3.06–3.40 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to three equivalent Li, four equivalent Sm, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.53 Å. In the second Ge site, Ge is bonded in a 1-coordinate geometry to two equivalent Li, five equivalent Sm, and two equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Dy3Ge13Rh4 by Materials Project

Dy3Rh4Ge13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Dy is bonded in a 8-coordinate geometry to four equivalent Rh and twelve equivalent Ge atoms. All Dy–Rh bond lengths are 3.19 Å. There are eight shorter (3.13 Å) and four longer (3.22 Å) Dy–Ge bond lengths. Rh is bonded in a 6-coordinate geometry to three equivalent Dy and six equivalent Ge atoms. All Rh–Ge bond lengths are 2.50 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 2-coordinate geometry to three equivalent Dy, two equivalent Rh, and one Ge atom. The Ge–Ge bond length is 3.10 Å. In the second Ge site, Ge is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ho3Ge13Ru4 by Materials Project

Ho3Ru4Ge13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Ho is bonded in a 8-coordinate geometry to four equivalent Ru and twelve equivalent Ge atoms. All Ho–Ru bond lengths are 3.19 Å. There are eight shorter (3.16 Å) and four longer (3.21 Å) Ho–Ge bond lengths. Ru is bonded in a 6-coordinate geometry to three equivalent Ho and six equivalent Ge atoms. All Ru–Ge bond lengths are 2.49 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 6-coordinate geometry to three equivalent Ho, two equivalent Ru, and two Ge atoms. There are one shorter (2.69 Å) and one longer (3.08 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PrFeGe3 by Materials Project

PrFeGe3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Pr is bonded in a 12-coordinate geometry to five equivalent Fe and twelve Ge atoms. There are one shorter (3.34 Å) and four longer (3.49 Å) Pr–Fe bond lengths. There are a spread of Pr–Ge bond distances ranging from 3.13–3.35 Å. Fe is bonded in a 5-coordinate geometry to five equivalent Pr and five Ge atoms. There are one shorter (2.27 Å) and four longer (2.35 Å) Fe–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 1-coordinate geometry to four equivalent Pr, one Fe, and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.84 Å. In the second Ge site, Ge is bonded in a 2-coordinate geometry to four equivalent Pr, two equivalent Fe, and two equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Mn4Co4Si3Ge by Materials Project

Mn4Co4GeSi3 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are four inequivalent Mn sites. In the first Mn site, Mn is bonded in a 11-coordinate geometry to six Co, two equivalent Ge, and three Si atoms. There are a spread of Mn–Co bond distances ranging from 2.66–2.83 Å. Both Mn–Ge bond lengths are 2.56 Å. There are one shorter (2.53 Å) and two longer (2.55 Å) Mn–Si bond lengths. In the second Mn site, Mn is bonded in a 11-coordinate geometry to six Co, two equivalent Ge, and three Si atoms. There are a spread of Mn–Co bond distances ranging from 2.68–2.80 Å. Both Mn–Ge bond lengths are 2.60 Å. There are two shorter (2.52 Å) and one longer (2.53 Å) Mn–Si bond lengths. In the third Mn site, Mn is bonded in a 11-coordinate geometry to six Co, one Ge, and four Si atoms. There are a spread of Mn–Co bond distances ranging from 2.64–2.76 Å. The Mn–Ge bond length is 2.57 Å. There are two shorter (2.52 Å) and two longer (2.56 Å) Mn–Si bond lengths. In the fourth Mn site, Mn is bonded in a 11-coordinate geometry to six Co and five Si atoms. There are a spread of Mn–Co bond distances ranging from 2.68–2.73 Å. There are three shorter (2.53 Å) and two longer (2.56 Å) Mn–Si bond lengths. There are four inequivalent Co sites. In the first Co site, Co is bonded in a 12-coordinate geometry to six Mn and four Si atoms. There are three shorter (2.27 Å) and one longer (2.29 Å) Co–Si bond lengths. In the second Co site, Co is bonded in a 12-coordinate geometry to six Mn, two equivalent Ge, and two Si atoms. Both Co–Ge bond lengths are 2.31 Å. There are one shorter (2.24 Å) and one longer (2.26 Å) Co–Si bond lengths. In the third Co site, Co is bonded in a 12-coordinate geometry to six Mn, one Ge, and three Si atoms. The Co–Ge bond length is 2.33 Å. There are two shorter (2.25 Å) and one longer (2.29 Å) Co–Si bond lengths. In the fourth Co site, Co is bonded in a 12-coordinate geometry to six Mn, one Ge, and three Si atoms. The Co–Ge bond length is 2.37 Å. There are two shorter (2.27 Å) and one longer (2.29 Å) Co–Si bond lengths. Ge is bonded in a 9-coordinate geometry to five Mn and four Co atoms. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to five Mn and four Co atoms. In the second Si site, Si is bonded in a 9-coordinate geometry to five Mn and four Co atoms. In the third Si site, Si is bonded in a 9-coordinate geometry to five Mn and four Co atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on BaGe3Ir by Materials Project

BaIrGe3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Ba is bonded in a 12-coordinate geometry to five equivalent Ir and twelve Ge atoms. There are one shorter (3.61 Å) and four longer (3.62 Å) Ba–Ir bond lengths. There are a spread of Ba–Ge bond distances ranging from 3.38–3.48 Å. Ir is bonded in a 5-coordinate geometry to five equivalent Ba and five Ge atoms. There are one shorter (2.48 Å) and four longer (2.53 Å) Ir–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 1-coordinate geometry to four equivalent Ba, one Ir, and four equivalent Ge atoms. All Ge–Ge bond lengths are 2.84 Å. In the second Ge site, Ge is bonded in a 2-coordinate geometry to four equivalent Ba, two equivalent Ir, and two equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on MnGe2Pd3 by Materials Project

Pd2(MnPd)Ge2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Mn is bonded in a 10-coordinate geometry to six Pd and four equivalent Ge atoms. There are a spread of Mn–Pd bond distances ranging from 2.78–2.85 Å. There are two shorter (2.69 Å) and two longer (2.74 Å) Mn–Ge bond lengths. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded in a 6-coordinate geometry to two equivalent Mn and four Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.54–2.58 Å. In the second Pd site, Pd is bonded in a 8-coordinate geometry to four equivalent Mn and four Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.58–2.62 Å. In the third Pd site, Pd is bonded in a 5-coordinate geometry to five Ge atoms. There are a spread of Pd–Ge bond distances ranging from 2.50–2.70 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 8-coordinate geometry to eight Pd atoms. In the second Ge site, Ge is bonded in a 9-coordinate geometry to four equivalent Mn and five Pd atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on PrGe2 by Materials Project

PrGe2 crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Pr is bonded to twelve Ge atoms to form a mixture of face and edge-sharing PrGe12 cuboctahedra. There are a spread of Pr–Ge bond distances ranging from 3.21–3.47 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six equivalent Pr and three Ge atoms. There are two shorter (2.57 Å) and one longer (2.59 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a 9-coordinate geometry to six equivalent Pr and three Ge atoms. Both Ge–Ge bond lengths are 2.52 Å.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Tm3Ge13Ir4 by Materials Project

Tm3Ir4Ge13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Tm is bonded in a 8-coordinate geometry to four equivalent Ir and twelve equivalent Ge atoms. All Tm–Ir bond lengths are 3.19 Å. There are eight shorter (3.12 Å) and four longer (3.25 Å) Tm–Ge bond lengths. Ir is bonded in a 6-coordinate geometry to three equivalent Tm and six equivalent Ge atoms. All Ir–Ge bond lengths are 2.51 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 6-coordinate geometry to three equivalent Tm, two equivalent Ir, and two Ge atoms. There are one shorter (2.62 Å) and one longer (3.09 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Ho3NiGe2 by Materials Project

Ho3NiGe2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are three inequivalent Ho sites. In the first Ho site, Ho is bonded in a 8-coordinate geometry to three equivalent Ni and five Ge atoms. There are one shorter (2.95 Å) and two longer (2.97 Å) Ho–Ni bond lengths. There are three shorter (2.97 Å) and two longer (3.06 Å) Ho–Ge bond lengths. In the second Ho site, Ho is bonded in a 6-coordinate geometry to one Ni and five Ge atoms. The Ho–Ni bond length is 2.83 Å. There are a spread of Ho–Ge bond distances ranging from 2.97–3.12 Å. In the third Ho site, Ho is bonded in a 7-coordinate geometry to two equivalent Ni and five Ge atoms. Both Ho–Ni bond lengths are 2.80 Å. There are a spread of Ho–Ge bond distances ranging from 2.98–3.59 Å. Ni is bonded in a 9-coordinate geometry to six Ho and three Ge atoms. There are one shorter (2.49 Å) and two longer (2.50 Å) Ni–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to seven Ho and two equivalent Ni atoms. In the second Ge site, Ge is bonded in a 9-coordinate geometry to eight Ho and one Ni atom.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Er3Ge13Os4 by Materials Project

Er3Os4Ge13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to four equivalent Os and twelve equivalent Ge atoms. All Er–Os bond lengths are 3.20 Å. There are eight shorter (3.18 Å) and four longer (3.25 Å) Er–Ge bond lengths. Os is bonded in a 6-coordinate geometry to three equivalent Er and six equivalent Ge atoms. All Os–Ge bond lengths are 2.50 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 2-coordinate geometry to three equivalent Er, two equivalent Os, and one Ge atom. The Ge–Ge bond length is 3.03 Å. In the second Ge site, Ge is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms.

36 MATERIALS SCIENCE↗
DOE OSTI2020

Materials Data on Nd3Ge13Os4 by Materials Project

Nd3Os4Ge13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Nd is bonded in a 8-coordinate geometry to four equivalent Os and twelve equivalent Ge atoms. All Nd–Os bond lengths are 3.25 Å. There are eight shorter (3.24 Å) and four longer (3.28 Å) Nd–Ge bond lengths. Os is bonded in a 6-coordinate geometry to three equivalent Nd and six equivalent Ge atoms. All Os–Ge bond lengths are 2.53 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 2-coordinate geometry to three equivalent Nd, two equivalent Os, and two Ge atoms. There are one shorter (2.70 Å) and one longer (3.06 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms.

36 MATERIALS SCIENCE↗