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DOE OSTI2020

Materials Data on Y2NiRu3 by Materials Project

Y2Ru3Ni is Cubic Laves-derived structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Y is bonded in a 12-coordinate geometry to nine equivalent Ru and three equivalent Ni atoms. There are six shorter (3.08 Å) and three longer (3.12 Å) Y–Ru bond lengths. All Y–Ni bond lengths are 3.08 Å. Ru is bonded to six equivalent Y, four equivalent Ru, and two equivalent Ni atoms to form RuY6Ni2Ru4 cuboctahedra that share corners with four equivalent NiY6Ru6 cuboctahedra, corners with fourteen equivalent RuY6Ni2Ru4 cuboctahedra, edges with six equivalent RuY6Ni2Ru4 cuboctahedra, faces with six equivalent NiY6Ru6 cuboctahedra, and faces with twelve equivalent RuY6Ni2Ru4 cuboctahedra. All Ru–Ru bond lengths are 2.63 Å. Both Ru–Ni bond lengths are 2.65 Å. Ni is bonded to six equivalent Y and six equivalent Ru atoms to form NiY6Ru6 cuboctahedra that share corners with six equivalent NiY6Ru6 cuboctahedra, corners with twelve equivalent RuY6Ni2Ru4 cuboctahedra, edges with six equivalent NiY6Ru6 cuboctahedra, and faces with eighteen equivalent RuY6Ni2Ru4 cuboctahedra.

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Materials Data on Lu3Ge3Ru2 by Materials Project

Lu3Ru2Ge3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded in a 10-coordinate geometry to four equivalent Ru and six Ge atoms. There are one shorter (3.07 Å) and three longer (3.11 Å) Lu–Ru bond lengths. There are a spread of Lu–Ge bond distances ranging from 2.96–3.10 Å. In the second Lu site, Lu is bonded in a 9-coordinate geometry to four equivalent Ru and five Ge atoms. All Lu–Ru bond lengths are 3.19 Å. There are a spread of Lu–Ge bond distances ranging from 2.89–3.25 Å. Ru is bonded in a 10-coordinate geometry to six Lu and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.44–2.66 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to five Lu, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.66 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Lu and two equivalent Ru atoms.

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Materials Data on Er3Ge3Ru2 by Materials Project

Er3Ru2Ge3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 10-coordinate geometry to four equivalent Ru and six Ge atoms. There are a spread of Er–Ru bond distances ranging from 3.09–3.15 Å. There are a spread of Er–Ge bond distances ranging from 2.98–3.13 Å. In the second Er site, Er is bonded in a 9-coordinate geometry to four equivalent Ru and five Ge atoms. All Er–Ru bond lengths are 3.22 Å. There are a spread of Er–Ge bond distances ranging from 2.92–3.31 Å. Ru is bonded in a 10-coordinate geometry to six Er and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.45–2.67 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to five Er, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.71 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Er and two equivalent Ru atoms.

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Materials Data on Ce2FeRu3 by Materials Project

Ce2Ru3Fe crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to four equivalent Ce, nine equivalent Ru, and three equivalent Fe atoms. There are one shorter (3.05 Å) and three longer (3.30 Å) Ce–Ce bond lengths. There are three shorter (2.91 Å) and six longer (3.14 Å) Ce–Ru bond lengths. All Ce–Fe bond lengths are 3.20 Å. Ru is bonded to six equivalent Ce, four equivalent Ru, and two equivalent Fe atoms to form distorted RuCe6Fe2Ru4 cuboctahedra that share corners with four equivalent FeCe6Ru6 cuboctahedra, corners with fourteen equivalent RuCe6Fe2Ru4 cuboctahedra, edges with six equivalent RuCe6Fe2Ru4 cuboctahedra, faces with six equivalent FeCe6Ru6 cuboctahedra, and faces with twelve equivalent RuCe6Fe2Ru4 cuboctahedra. All Ru–Ru bond lengths are 2.74 Å. Both Ru–Fe bond lengths are 2.54 Å. Fe is bonded to six equivalent Ce and six equivalent Ru atoms to form distorted FeCe6Ru6 cuboctahedra that share corners with six equivalent FeCe6Ru6 cuboctahedra, corners with twelve equivalent RuCe6Fe2Ru4 cuboctahedra, edges with six equivalent FeCe6Ru6 cuboctahedra, and faces with eighteen equivalent RuCe6Fe2Ru4 cuboctahedra.

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Materials Data on HoFeRu by Materials Project

HoRuFe crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Ho is bonded in a 12-coordinate geometry to six equivalent Ru and six equivalent Fe atoms. There are four shorter (3.01 Å) and two longer (3.03 Å) Ho–Ru bond lengths. There are two shorter (2.96 Å) and four longer (3.10 Å) Ho–Fe bond lengths. Ru is bonded to six equivalent Ho, two equivalent Ru, and four equivalent Fe atoms to form distorted RuHo6Fe4Ru2 cuboctahedra that share corners with eight equivalent FeHo6Fe2Ru4 cuboctahedra, corners with ten equivalent RuHo6Fe4Ru2 cuboctahedra, edges with six equivalent RuHo6Fe4Ru2 cuboctahedra, faces with six equivalent RuHo6Fe4Ru2 cuboctahedra, and faces with twelve equivalent FeHo6Fe2Ru4 cuboctahedra. Both Ru–Ru bond lengths are 2.67 Å. All Ru–Fe bond lengths are 2.58 Å. Fe is bonded to six equivalent Ho, four equivalent Ru, and two equivalent Fe atoms to form FeHo6Fe2Ru4 cuboctahedra that share corners with eight equivalent RuHo6Fe4Ru2 cuboctahedra, corners with ten equivalent FeHo6Fe2Ru4 cuboctahedra, edges with six equivalent FeHo6Fe2Ru4 cuboctahedra, faces with six equivalent FeHo6Fe2Ru4 cuboctahedra, and faces with twelve equivalent RuHo6Fe4Ru2 cuboctahedra. Both Fe–Fe bond lengths are 2.54 Å.

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Materials Data on Ho2Ge2Ru by Materials Project

Ho2RuGe2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded in a 2-coordinate geometry to four equivalent Ru and seven Ge atoms. There are a spread of Ho–Ru bond distances ranging from 3.06–3.17 Å. There are a spread of Ho–Ge bond distances ranging from 2.94–3.43 Å. In the second Ho site, Ho is bonded in a 6-coordinate geometry to two equivalent Ru and six Ge atoms. Both Ho–Ru bond lengths are 3.28 Å. There are a spread of Ho–Ge bond distances ranging from 2.90–3.20 Å. Ru is bonded in a 10-coordinate geometry to six Ho and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.46–2.62 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Ho, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.75 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Ho, one Ru, and one Ge atom. The Ge–Ge bond length is 2.66 Å.

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Materials Data on IrOsRu by Materials Project

OsRuIr is Copper-derived structured and crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Os is bonded to six equivalent Os, three equivalent Ru, and three equivalent Ir atoms to form OsIr3Os6Ru3 cuboctahedra that share corners with three equivalent RuIr3Os3Ru6 cuboctahedra, corners with three equivalent IrIr6Os3Ru3 cuboctahedra, corners with six equivalent OsIr3Os6Ru3 cuboctahedra, edges with six equivalent OsIr3Os6Ru3 cuboctahedra, edges with nine equivalent RuIr3Os3Ru6 cuboctahedra, edges with nine equivalent IrIr6Os3Ru3 cuboctahedra, faces with six equivalent OsIr3Os6Ru3 cuboctahedra, faces with six equivalent RuIr3Os3Ru6 cuboctahedra, and faces with six equivalent IrIr6Os3Ru3 cuboctahedra. All Os–Os bond lengths are 2.73 Å. All Os–Ru bond lengths are 2.67 Å. All Os–Ir bond lengths are 2.75 Å. Ru is bonded to three equivalent Os, six equivalent Ru, and three equivalent Ir atoms to form RuIr3Os3Ru6 cuboctahedra that share corners with three equivalent OsIr3Os6Ru3 cuboctahedra, corners with three equivalent IrIr6Os3Ru3 cuboctahedra, corners with six equivalent RuIr3Os3Ru6 cuboctahedra, edges with six equivalent RuIr3Os3Ru6 cuboctahedra, edges with nine equivalent OsIr3Os6Ru3 cuboctahedra, edges with nine equivalent IrIr6Os3Ru3 cuboctahedra, faces with six equivalent OsIr3Os6Ru3 cuboctahedra, faces with six equivalent RuIr3Os3Ru6 cuboctahedra, and faces with six equivalent IrIr6Os3Ru3 cuboctahedra. All Ru–Ru bond lengths are 2.73 Å. All Ru–Ir bond lengths are 2.76 Å. Ir is bonded to three equivalent Os, three equivalent Ru, and six equivalent Ir atoms to form IrIr6Os3Ru3 cuboctahedra that share corners with three equivalent OsIr3Os6Ru3 cuboctahedra, corners with three equivalent RuIr3Os3Ru6 cuboctahedra, corners with six equivalent IrIr6Os3Ru3 cuboctahedra, edges with six equivalent IrIr6Os3Ru3 cuboctahedra, edges with nine equivalent OsIr3Os6Ru3 cuboctahedra, edges with nine equivalent RuIr3Os3Ru6 cuboctahedra, faces with six equivalent OsIr3Os6Ru3 cuboctahedra, faces with six equivalent RuIr3Os3Ru6 cuboctahedra, and faces with six equivalent IrIr6Os3Ru3 cuboctahedra. All Ir–Ir bond lengths are 2.73 Å.

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Materials Data on KRu2C4(ClO4)2 by Materials Project

KRu2C4(O4Cl)2 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. K1+ is bonded in a 8-coordinate geometry to four O2- and four equivalent Cl1- atoms. There are two shorter (2.81 Å) and two longer (3.16 Å) K–O bond lengths. There are two shorter (3.21 Å) and two longer (3.48 Å) K–Cl bond lengths. Ru+4.50+ is bonded in a square pyramidal geometry to four O2- and one Cl1- atom. There are two shorter (2.15 Å) and two longer (2.16 Å) Ru–O bond lengths. The Ru–Cl bond length is 2.49 Å. There are two inequivalent C2+ sites. In the first C2+ site, C2+ is bonded in a distorted bent 150 degrees geometry to two O2- atoms. Both C–O bond lengths are 1.23 Å. In the second C2+ site, C2+ is bonded in a distorted bent 150 degrees geometry to two O2- atoms. There is one shorter (1.23 Å) and one longer (1.24 Å) C–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 120 degrees geometry to one Ru+4.50+ and one C2+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one K1+, one Ru+4.50+, and one C2+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Ru+4.50+ and one C2+ atom. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to one K1+, one Ru+4.50+, and one C2+ atom. Cl1- is bonded in a 2-coordinate geometry to two equivalent K1+ and one Ru+4.50+ atom.

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Materials Data on Tm3Ge3Ru2 by Materials Project

Tm3Ru2Ge3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Tm sites. In the first Tm site, Tm is bonded in a 2-coordinate geometry to four equivalent Ru and six Ge atoms. There are a spread of Tm–Ru bond distances ranging from 3.08–3.13 Å. There are a spread of Tm–Ge bond distances ranging from 2.97–3.12 Å. In the second Tm site, Tm is bonded in a 9-coordinate geometry to four equivalent Ru and five Ge atoms. All Tm–Ru bond lengths are 3.21 Å. There are a spread of Tm–Ge bond distances ranging from 2.91–3.29 Å. Ru is bonded in a 10-coordinate geometry to six Tm and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.44–2.67 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to five Tm, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.69 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Tm and two equivalent Ru atoms.

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Materials Data on NbPRu by Materials Project

NbRuP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Nb is bonded in a 5-coordinate geometry to six equivalent Ru and five equivalent P atoms. There are a spread of Nb–Ru bond distances ranging from 2.88–2.95 Å. There are a spread of Nb–P bond distances ranging from 2.64–2.73 Å. Ru is bonded in a 12-coordinate geometry to six equivalent Nb, two equivalent Ru, and four equivalent P atoms. Both Ru–Ru bond lengths are 2.78 Å. There are a spread of Ru–P bond distances ranging from 2.37–2.43 Å. P is bonded in a 9-coordinate geometry to five equivalent Nb and four equivalent Ru atoms.

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Materials Data on Tb3Ge3Ru2 by Materials Project

Tb3Ru2Ge3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Tb sites. In the first Tb site, Tb is bonded in a 2-coordinate geometry to four equivalent Ru and seven Ge atoms. There are a spread of Tb–Ru bond distances ranging from 3.10–3.23 Å. There are a spread of Tb–Ge bond distances ranging from 3.04–3.46 Å. In the second Tb site, Tb is bonded in a 4-coordinate geometry to four equivalent Ru and five Ge atoms. All Tb–Ru bond lengths are 3.29 Å. There are a spread of Tb–Ge bond distances ranging from 2.95–3.42 Å. Ru is bonded in a 10-coordinate geometry to six Tb and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.46–2.71 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Tb, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.83 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Tb and two equivalent Ru atoms.

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Materials Data on Dy2Ge2Ru by Materials Project

Dy2RuGe2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are two inequivalent Dy sites. In the first Dy site, Dy is bonded in a 2-coordinate geometry to four equivalent Ru and seven Ge atoms. There are a spread of Dy–Ru bond distances ranging from 3.06–3.19 Å. There are a spread of Dy–Ge bond distances ranging from 2.95–3.43 Å. In the second Dy site, Dy is bonded in a 6-coordinate geometry to two equivalent Ru and six Ge atoms. Both Dy–Ru bond lengths are 3.30 Å. There are a spread of Dy–Ge bond distances ranging from 2.91–3.22 Å. Ru is bonded in a 10-coordinate geometry to six Dy and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.46–2.62 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Dy, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.78 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Dy, one Ru, and one Ge atom. The Ge–Ge bond length is 2.65 Å.

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Materials Data on K5NaRu(IO11)2 by Materials Project

K5NaRu(O11I)2 crystallizes in the monoclinic Cc space group. The structure is three-dimensional. there are five inequivalent K sites. In the first K site, K is bonded in a 5-coordinate geometry to five O atoms. There are a spread of K–O bond distances ranging from 2.74–3.00 Å. In the second K site, K is bonded in a 5-coordinate geometry to nine O atoms. There are a spread of K–O bond distances ranging from 2.61–3.31 Å. In the third K site, K is bonded in a 7-coordinate geometry to seven O atoms. There are a spread of K–O bond distances ranging from 2.67–3.18 Å. In the fourth K site, K is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of K–O bond distances ranging from 2.72–3.33 Å. In the fifth K site, K is bonded in a 2-coordinate geometry to six O atoms. There are a spread of K–O bond distances ranging from 2.73–3.28 Å. Na is bonded in a 6-coordinate geometry to six O atoms. There are a spread of Na–O bond distances ranging from 2.28–2.62 Å. Ru is bonded to six O atoms to form distorted RuO6 octahedra that share an edgeedge with one IO6 octahedra. There are a spread of Ru–O bond distances ranging from 1.75–2.22 Å. There are twenty-two inequivalent O sites. In the first O site, O is bonded to two K, one Ru, and one I atom to form distorted corner-sharing OK2RuI tetrahedra. The O–I bond length is 2.09 Å. In the second O site, O is bonded to two K, one Ru, and one I atom to form distorted corner-sharing OK2RuI trigonal pyramids. The O–I bond length is 1.96 Å. In the third O site, O is bonded in a 3-coordinate geometry to two K and one I atom. The O–I bond length is 1.87 Å. In the fourth O site, O is bonded in a distorted trigonal non-coplanar geometry to one Na, one O, and one I atom. The O–O bond length is 1.29 Å. The O–I bond length is 2.39 Å. In the fifth O site, O is bonded in a 4-coordinate geometry to three K and one I atom. The O–I bond length is 1.83 Å. In the sixth O site, O is bonded in a distorted trigonal non-coplanar geometry to two K and one I atom. The O–I bond length is 1.84 Å. In the seventh O site, O is bonded in a distorted L-shaped geometry to one Na and one O atom. The O–O bond length is 1.35 Å. In the eighth O site, O is bonded in a 2-coordinate geometry to two K and one Na atom. In the ninth O site, O is bonded in a distorted T-shaped geometry to two K and one I atom. The O–I bond length is 1.92 Å. In the tenth O site, O is bonded in a distorted T-shaped geometry to two K and one I atom. The O–I bond length is 1.80 Å. In the eleventh O site, O is bonded in a 1-coordinate geometry to one K and one I atom. The O–I bond length is 1.85 Å. In the twelfth O site, O is bonded in a distorted single-bond geometry to two K and one O atom. The O–O bond length is 1.28 Å. In the thirteenth O site, O is bonded in a distorted trigonal non-coplanar geometry to one K, one Na, and one O atom. The O–O bond length is 1.34 Å. In the fourteenth O site, O is bonded in a 2-coordinate geometry to two K, one Na, and one O atom. In the fifteenth O site, O is bonded in a water-like geometry to one Ru and one I atom. The O–I bond length is 2.06 Å. In the sixteenth O site, O is bonded in a distorted water-like geometry to one K, one Ru, and one I atom. The O–I bond length is 1.93 Å. In the seventeenth O site, O is bonded in a linear geometry to two K atoms. In the eighteenth O site, O is bonded in a bent 150 degrees geometry to two K atoms. In the nineteenth O site, O is bonded in a trigonal non-coplanar geometry to one K and two O atoms. In the twentieth O site, O is bonded to two K, one Na, and one O atom to form distorted corner-sharing OK2NaO tetrahedra. In the twenty-first O site, O is bonded in a 3-coordinate geometry to two K and one Ru atom. In the twenty-second O site, O is bonded in a single-bond geometry to two K and one Ru atom. There are two inequivalent I sites. In the first I site, I is bonded to six O atoms to form IO6 octahedra that share an edgeedge with one RuO6 octahedra. In the second I site, I is bonded in a 5-coordinate geometry to five O atoms.

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Materials Data on Er2Ge2Ru by Materials Project

Er2RuGe2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are two inequivalent Er sites. In the first Er site, Er is bonded in a 2-coordinate geometry to four equivalent Ru and seven Ge atoms. There are a spread of Er–Ru bond distances ranging from 3.05–3.15 Å. There are a spread of Er–Ge bond distances ranging from 2.93–3.41 Å. In the second Er site, Er is bonded in a 6-coordinate geometry to two equivalent Ru and six Ge atoms. Both Er–Ru bond lengths are 3.27 Å. There are a spread of Er–Ge bond distances ranging from 2.90–3.17 Å. Ru is bonded in a 10-coordinate geometry to six Er and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.45–2.61 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Er, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.72 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Er, one Ru, and one Ge atom. The Ge–Ge bond length is 2.65 Å.

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Materials Data on Dy3Ge3Ru2 by Materials Project

Dy3Ru2Ge3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Dy sites. In the first Dy site, Dy is bonded in a 2-coordinate geometry to four equivalent Ru and seven Ge atoms. There are a spread of Dy–Ru bond distances ranging from 3.10–3.21 Å. There are a spread of Dy–Ge bond distances ranging from 3.03–3.47 Å. In the second Dy site, Dy is bonded in a 4-coordinate geometry to four equivalent Ru and five Ge atoms. All Dy–Ru bond lengths are 3.28 Å. There are a spread of Dy–Ge bond distances ranging from 2.95–3.39 Å. Ru is bonded in a 10-coordinate geometry to six Dy and four Ge atoms. There are a spread of Ru–Ge bond distances ranging from 2.46–2.71 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 10-coordinate geometry to six Dy, three equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.79 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to seven Dy and two equivalent Ru atoms.

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Materials Data on CeOsRu by Materials Project

CeOsRu is Cubic Laves-derived structured and crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to six equivalent Os and six equivalent Ru atoms. There are two shorter (3.14 Å) and four longer (3.21 Å) Ce–Os bond lengths. There are four shorter (3.10 Å) and two longer (3.19 Å) Ce–Ru bond lengths. Os is bonded to six equivalent Ce, two equivalent Os, and four equivalent Ru atoms to form OsCe6Os2Ru4 cuboctahedra that share corners with eight equivalent RuCe6Os4Ru2 cuboctahedra, corners with ten equivalent OsCe6Os2Ru4 cuboctahedra, edges with six equivalent OsCe6Os2Ru4 cuboctahedra, faces with six equivalent OsCe6Os2Ru4 cuboctahedra, and faces with twelve equivalent RuCe6Os4Ru2 cuboctahedra. Both Os–Os bond lengths are 2.61 Å. All Os–Ru bond lengths are 2.70 Å. Ru is bonded to six equivalent Ce, four equivalent Os, and two equivalent Ru atoms to form RuCe6Os4Ru2 cuboctahedra that share corners with eight equivalent OsCe6Os2Ru4 cuboctahedra, corners with ten equivalent RuCe6Os4Ru2 cuboctahedra, edges with six equivalent RuCe6Os4Ru2 cuboctahedra, faces with six equivalent RuCe6Os4Ru2 cuboctahedra, and faces with twelve equivalent OsCe6Os2Ru4 cuboctahedra. Both Ru–Ru bond lengths are 2.77 Å.

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Materials Data on LaCeRu4 by Materials Project

CeLaRu4 is Cubic Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to twelve equivalent Ru atoms. All Ce–Ru bond lengths are 3.17 Å. La is bonded in a 12-coordinate geometry to twelve equivalent Ru atoms. All La–Ru bond lengths are 3.17 Å. Ru is bonded to three equivalent Ce, three equivalent La, and six equivalent Ru atoms to form a mixture of face, edge, and corner-sharing RuLa3Ce3Ru6 cuboctahedra. There are three shorter (2.70 Å) and three longer (2.71 Å) Ru–Ru bond lengths.

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Materials Data on ErFeRu by Materials Project

ErRuFe crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Er is bonded in a 12-coordinate geometry to six equivalent Ru and six equivalent Fe atoms. There are four shorter (3.04 Å) and two longer (3.07 Å) Er–Ru bond lengths. There are two shorter (3.05 Å) and four longer (3.11 Å) Er–Fe bond lengths. Ru is bonded to six equivalent Er, two equivalent Ru, and four equivalent Fe atoms to form distorted RuEr6Fe4Ru2 cuboctahedra that share corners with eight equivalent FeEr6Fe2Ru4 cuboctahedra, corners with ten equivalent RuEr6Fe4Ru2 cuboctahedra, edges with six equivalent RuEr6Fe4Ru2 cuboctahedra, faces with six equivalent RuEr6Fe4Ru2 cuboctahedra, and faces with twelve equivalent FeEr6Fe2Ru4 cuboctahedra. Both Ru–Ru bond lengths are 2.68 Å. All Ru–Fe bond lengths are 2.62 Å. Fe is bonded to six equivalent Er, four equivalent Ru, and two equivalent Fe atoms to form FeEr6Fe2Ru4 cuboctahedra that share corners with eight equivalent RuEr6Fe4Ru2 cuboctahedra, corners with ten equivalent FeEr6Fe2Ru4 cuboctahedra, edges with six equivalent FeEr6Fe2Ru4 cuboctahedra, faces with six equivalent FeEr6Fe2Ru4 cuboctahedra, and faces with twelve equivalent RuEr6Fe4Ru2 cuboctahedra. Both Fe–Fe bond lengths are 2.56 Å.

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