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Materials Data on Ce3(MgRh2)2 by Materials Project

Ce3(MgRh2)2 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. Mg is bonded to five Rh atoms to form a mixture of distorted face and corner-sharing MgRh5 tetrahedra. There are a spread of Mg–Rh bond distances ranging from 2.62–3.27 Å. There are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 5-coordinate geometry to seven Rh atoms. There are a spread of Ce–Rh bond distances ranging from 2.86–3.28 Å. In the second Ce site, Ce is bonded in a 7-coordinate geometry to seven Rh atoms. There are a spread of Ce–Rh bond distances ranging from 2.83–3.13 Å. There are three inequivalent Rh sites. In the first Rh site, Rh is bonded in a 8-coordinate geometry to two equivalent Mg, six Ce, and one Rh atom. The Rh–Rh bond length is 3.01 Å. In the second Rh site, Rh is bonded in a 7-coordinate geometry to four equivalent Mg, three Ce, and two equivalent Rh atoms. Both Rh–Rh bond lengths are 2.87 Å. In the third Rh site, Rh is bonded in a 4-coordinate geometry to two equivalent Mg, six Ce, and four Rh atoms.

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Materials Data on Li(CeGe)4 by Materials Project

Ce4LiGe4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li is bonded in a T-shaped geometry to five Ge atoms. There are a spread of Li–Ge bond distances ranging from 2.76–3.26 Å. There are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 7-coordinate geometry to seven Ge atoms. There are a spread of Ce–Ge bond distances ranging from 3.06–3.54 Å. In the second Ce site, Ce is bonded in a 6-coordinate geometry to six Ge atoms. There are a spread of Ce–Ge bond distances ranging from 2.95–3.14 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to two equivalent Li, six Ce, and one Ge atom. The Ge–Ge bond length is 2.59 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to one Li, seven Ce, and one Ge atom. The Ge–Ge bond length is 2.67 Å. In the third Ge site, Ge is bonded in a 8-coordinate geometry to one Li, six Ce, and one Ge atom.

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Materials Data on Ce2Al3GaPd4 by Materials Project

Ce2Pd4GaAl3 crystallizes in the tetragonal P-4m2 space group. The structure is three-dimensional. Ce is bonded in a 4-coordinate geometry to eight Pd, two equivalent Ga, and six Al atoms. There are four shorter (3.24 Å) and four longer (3.41 Å) Ce–Pd bond lengths. Both Ce–Ga bond lengths are 3.33 Å. There are four shorter (3.32 Å) and two longer (3.33 Å) Ce–Al bond lengths. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded to four equivalent Ce and four equivalent Al atoms to form distorted PdCe4Al4 tetrahedra that share corners with four equivalent GaCe4Pd4 tetrahedra, corners with eight equivalent AlCe4Pd4 tetrahedra, edges with two equivalent GaCe4Pd4 tetrahedra, edges with four equivalent PdCe4Al4 tetrahedra, and faces with four equivalent PdCe4Al4 tetrahedra. All Pd–Al bond lengths are 2.51 Å. In the second Pd site, Pd is bonded to four equivalent Ce and four equivalent Al atoms to form distorted PdCe4Al4 tetrahedra that share corners with four equivalent AlCe4Pd4 tetrahedra, corners with eight equivalent GaCe4Pd4 tetrahedra, edges with two equivalent AlCe4Pd4 tetrahedra, edges with four equivalent PdCe4Al4 tetrahedra, and faces with four equivalent PdCe4Al4 tetrahedra. All Pd–Al bond lengths are 2.51 Å. In the third Pd site, Pd is bonded in a 9-coordinate geometry to four equivalent Ce, two equivalent Ga, and three Al atoms. Both Pd–Ga bond lengths are 2.57 Å. There are one shorter (2.49 Å) and two longer (2.57 Å) Pd–Al bond lengths. Ga is bonded to four equivalent Ce and four equivalent Pd atoms to form distorted GaCe4Pd4 tetrahedra that share corners with twelve PdCe4Al4 tetrahedra, edges with two equivalent PdCe4Al4 tetrahedra, edges with four equivalent GaCe4Pd4 tetrahedra, and faces with four equivalent AlCe4Pd4 tetrahedra. There are two inequivalent Al sites. In the first Al site, Al is bonded to four equivalent Ce and four equivalent Pd atoms to form distorted AlCe4Pd4 tetrahedra that share corners with twelve PdCe4Al4 tetrahedra, edges with two equivalent PdCe4Al4 tetrahedra, edges with four equivalent AlCe4Pd4 tetrahedra, and faces with four equivalent GaCe4Pd4 tetrahedra. In the second Al site, Al is bonded in a 5-coordinate geometry to four equivalent Ce and five Pd atoms.

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Materials Data on CeIn3Pt by Materials Project

CePtIn3 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a cuboctahedral geometry to twelve equivalent In atoms. All Ce–In bond lengths are 3.48 Å. In the second Ce site, Ce is bonded in a 8-coordinate geometry to four equivalent Pt and twelve equivalent In atoms. All Ce–Pt bond lengths are 3.48 Å. There are eight shorter (3.38 Å) and four longer (3.49 Å) Ce–In bond lengths. Pt is bonded in a 6-coordinate geometry to three equivalent Ce and six equivalent In atoms. All Pt–In bond lengths are 2.73 Å. In is bonded in a 2-coordinate geometry to four Ce and two equivalent Pt atoms.

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Materials Data on CeNd3(Fe14B)2 by Materials Project

Nd3Ce(Fe14B)2 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are three inequivalent Nd sites. In the first Nd site, Nd is bonded in a 12-coordinate geometry to sixteen Fe atoms. There are a spread of Nd–Fe bond distances ranging from 3.04–3.25 Å. In the second Nd site, Nd is bonded in a 1-coordinate geometry to one Nd, two equivalent Ce, sixteen Fe, and one B atom. The Nd–Nd bond length is 3.51 Å. Both Nd–Ce bond lengths are 3.76 Å. There are a spread of Nd–Fe bond distances ranging from 3.06–3.37 Å. The Nd–B bond length is 2.87 Å. In the third Nd site, Nd is bonded in a 1-coordinate geometry to sixteen Fe and one B atom. There are a spread of Nd–Fe bond distances ranging from 3.06–3.37 Å. The Nd–B bond length is 2.88 Å. Ce is bonded in a 12-coordinate geometry to two equivalent Nd and sixteen Fe atoms. There are a spread of Ce–Fe bond distances ranging from 3.03–3.25 Å. There are twelve inequivalent Fe sites. In the first Fe site, Fe is bonded to one Nd, one Ce, and ten Fe atoms to form a mixture of distorted face, edge, and corner-sharing FeCeNdFe10 cuboctahedra. There are a spread of Fe–Fe bond distances ranging from 2.38–2.65 Å. In the second Fe site, Fe is bonded to two Nd and ten Fe atoms to form distorted FeNd2Fe10 cuboctahedra that share corners with ten FeNd2Fe10 cuboctahedra, edges with two FeNd2Fe10 cuboctahedra, and faces with eleven FeCeNdFe10 cuboctahedra. There are a spread of Fe–Fe bond distances ranging from 2.38–2.65 Å. In the third Fe site, Fe is bonded to two equivalent Nd, two equivalent Ce, and eight Fe atoms to form a mixture of face and corner-sharing FeCe2Nd2Fe8 cuboctahedra. All Fe–Fe bond lengths are 2.56 Å. In the fourth Fe site, Fe is bonded to four Nd and eight Fe atoms to form FeNd4Fe8 cuboctahedra that share corners with twenty FeNd2Fe10 cuboctahedra and faces with twelve FeCeNdFe10 cuboctahedra. All Fe–Fe bond lengths are 2.56 Å. In the fifth Fe site, Fe is bonded in a 2-coordinate geometry to one Nd, one Ce, and twelve Fe atoms. There are a spread of Fe–Fe bond distances ranging from 2.63–2.77 Å. In the sixth Fe site, Fe is bonded in a distorted water-like geometry to two equivalent Nd, four Fe, and two equivalent B atoms. There are two shorter (2.51 Å) and two longer (2.77 Å) Fe–Fe bond lengths. Both Fe–B bond lengths are 2.08 Å. In the seventh Fe site, Fe is bonded in a 2-coordinate geometry to two Nd and twelve Fe atoms. There are a spread of Fe–Fe bond distances ranging from 2.64–2.76 Å. In the eighth Fe site, Fe is bonded in a distorted water-like geometry to two equivalent Ce, four Fe, and two equivalent B atoms. Both Fe–Fe bond lengths are 2.50 Å. Both Fe–B bond lengths are 2.08 Å. In the ninth Fe site, Fe is bonded in a distorted single-bond geometry to one Nd, one Ce, seven Fe, and one B atom. The Fe–Fe bond length is 2.57 Å. The Fe–B bond length is 2.08 Å. In the tenth Fe site, Fe is bonded in a distorted single-bond geometry to two Nd, seven Fe, and one B atom. The Fe–Fe bond length is 2.57 Å. The Fe–B bond length is 2.09 Å. In the eleventh Fe site, Fe is bonded to two equivalent Nd, one Ce, and nine Fe atoms to form a mixture of distorted face, edge, and corner-sharing FeCeNd2Fe9 cuboctahedra. The Fe–Fe bond length is 2.43 Å. In the twelfth Fe site, Fe is bonded to three Nd and nine Fe atoms to form distorted FeNd3Fe9 cuboctahedra that share corners with fourteen FeCeNdFe10 cuboctahedra, edges with three FeNd2Fe10 cuboctahedra, and faces with twelve FeCeNdFe10 cuboctahedra. The Fe–Fe bond length is 2.42 Å. There are two inequivalent B sites. In the first B site, B is bonded in a 6-coordinate geometry to one Nd and six Fe atoms. In the second B site, B is bonded in a 6-coordinate geometry to one Nd and six Fe atoms.

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Materials Data on CeIn7Cu5 by Materials Project

CeCu5In7 crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to ten Cu and ten In atoms. There are a spread of Ce–Cu bond distances ranging from 3.51–3.71 Å. There are a spread of Ce–In bond distances ranging from 3.21–3.50 Å. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 12-coordinate geometry to two equivalent Ce, three Cu, and seven In atoms. There are a spread of Cu–Cu bond distances ranging from 2.70–2.81 Å. There are a spread of Cu–In bond distances ranging from 2.72–3.03 Å. In the second Cu site, Cu is bonded to two equivalent Ce, four equivalent Cu, and six In atoms to form distorted edge-sharing CuCe2In6Cu4 cuboctahedra. There are a spread of Cu–In bond distances ranging from 2.80–2.94 Å. There are five inequivalent In sites. In the first In site, In is bonded in a 5-coordinate geometry to one Ce, four equivalent Cu, and five In atoms. There are a spread of In–In bond distances ranging from 2.99–3.20 Å. In the second In site, In is bonded in a 8-coordinate geometry to one Ce, six Cu, and three In atoms. Both In–In bond lengths are 3.36 Å. In the third In site, In is bonded in a 10-coordinate geometry to one Ce, five Cu, and four In atoms. There are a spread of In–In bond distances ranging from 3.02–3.16 Å. In the fourth In site, In is bonded in a 12-coordinate geometry to two equivalent Ce, four equivalent Cu, and six In atoms. Both In–In bond lengths are 2.96 Å. In the fifth In site, In is bonded in a 12-coordinate geometry to two equivalent Ce, five Cu, and five In atoms.

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Materials Data on CeGe3Ru by Materials Project

CeRuGe3 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 8-coordinate geometry to four equivalent Ru and twelve equivalent Ge atoms. All Ce–Ru bond lengths are 3.21 Å. There are eight shorter (3.09 Å) and four longer (3.22 Å) Ce–Ge bond lengths. In the second Ce site, Ce is bonded in a cuboctahedral geometry to twelve equivalent Ge atoms. All Ce–Ge bond lengths are 3.26 Å. Ru is bonded in a 9-coordinate geometry to three equivalent Ce and six equivalent Ge atoms. All Ru–Ge bond lengths are 2.53 Å. Ge is bonded in a 2-coordinate geometry to four Ce, two equivalent Ru, and three equivalent Ge atoms. There are one shorter (2.77 Å) and two longer (2.85 Å) Ge–Ge bond lengths.

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Materials Data on Ce4Mg7Ge6 by Materials Project

Mg7Ce4Ge6 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are four inequivalent Mg sites. In the first Mg site, Mg is bonded in a 4-coordinate geometry to four Ge atoms. There are a spread of Mg–Ge bond distances ranging from 2.72–2.98 Å. In the second Mg site, Mg is bonded to four Ge atoms to form distorted MgGe4 tetrahedra that share corners with two equivalent CeGe6 octahedra, corners with six MgGe4 tetrahedra, edges with two equivalent CeGe6 octahedra, and an edgeedge with one MgGe4 tetrahedra. The corner-sharing octahedral tilt angles are 47°. There are a spread of Mg–Ge bond distances ranging from 2.80–2.88 Å. In the third Mg site, Mg is bonded to four Ge atoms to form distorted MgGe4 tetrahedra that share corners with three equivalent CeGe6 octahedra, corners with six MgGe4 tetrahedra, and edges with three equivalent CeGe6 octahedra. The corner-sharing octahedra tilt angles range from 14–62°. There are a spread of Mg–Ge bond distances ranging from 2.67–2.94 Å. In the fourth Mg site, Mg is bonded in a 4-coordinate geometry to four equivalent Ge atoms. All Mg–Ge bond lengths are 2.97 Å. There are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 5-coordinate geometry to five Ge atoms. There are two shorter (3.17 Å) and three longer (3.21 Å) Ce–Ge bond lengths. In the second Ce site, Ce is bonded to six Ge atoms to form distorted CeGe6 octahedra that share corners with five MgGe4 tetrahedra, edges with four equivalent CeGe6 octahedra, and edges with five MgGe4 tetrahedra. There are a spread of Ce–Ge bond distances ranging from 3.14–3.38 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to five Mg and four Ce atoms. In the second Ge site, Ge is bonded in a 7-coordinate geometry to four Mg and three equivalent Ce atoms. In the third Ge site, Ge is bonded in a 9-coordinate geometry to five Mg and four Ce atoms.

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Materials Data on CeB2Ir2Rh by Materials Project

CeIr2RhB2 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to two equivalent Ce, eight equivalent Ir, four equivalent Rh, and six equivalent B atoms. Both Ce–Ce bond lengths are 3.13 Å. All Ce–Ir bond lengths are 3.17 Å. All Ce–Rh bond lengths are 3.18 Å. All Ce–B bond lengths are 3.19 Å. Ir is bonded in a distorted square co-planar geometry to four equivalent Ce and four equivalent B atoms. All Ir–B bond lengths are 2.23 Å. Rh is bonded in a distorted square co-planar geometry to four equivalent Ce and four equivalent B atoms. All Rh–B bond lengths are 2.24 Å. B is bonded in a 6-coordinate geometry to three equivalent Ce, four equivalent Ir, and two equivalent Rh atoms.

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Materials Data on Ce5Sn3Au by Materials Project

Ce5AuSn3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 7-coordinate geometry to two equivalent Au and five equivalent Sn atoms. Both Ce–Au bond lengths are 3.10 Å. There are a spread of Ce–Sn bond distances ranging from 3.24–3.46 Å. In the second Ce site, Ce is bonded in a 6-coordinate geometry to six equivalent Sn atoms. All Ce–Sn bond lengths are 3.41 Å. Au is bonded to six equivalent Ce atoms to form face-sharing AuCe6 octahedra. Sn is bonded in a 9-coordinate geometry to nine Ce atoms.

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Materials Data on CeB2Ru2Rh by Materials Project

CeRu2RhB2 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to two equivalent Ce, eight equivalent Ru, four equivalent Rh, and six equivalent B atoms. Both Ce–Ce bond lengths are 3.00 Å. All Ce–Ru bond lengths are 3.14 Å. All Ce–Rh bond lengths are 3.19 Å. There are two shorter (3.12 Å) and four longer (3.25 Å) Ce–B bond lengths. Ru is bonded in a distorted square co-planar geometry to four equivalent Ce and four equivalent B atoms. All Ru–B bond lengths are 2.19 Å. Rh is bonded in a distorted square co-planar geometry to four equivalent Ce and four equivalent B atoms. All Rh–B bond lengths are 2.22 Å. B is bonded in a 6-coordinate geometry to three equivalent Ce, four equivalent Ru, and two equivalent Rh atoms.

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Materials Data on Ce2Si3 by Materials Project

Ce2Si3 crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 8-coordinate geometry to eight Si atoms. There are a spread of Ce–Si bond distances ranging from 3.02–3.13 Å. In the second Ce site, Ce is bonded in a 10-coordinate geometry to ten Si atoms. There are a spread of Ce–Si bond distances ranging from 3.06–3.19 Å. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 7-coordinate geometry to six Ce and one Si atom. The Si–Si bond length is 2.33 Å. In the second Si site, Si is bonded in a 8-coordinate geometry to six Ce and two equivalent Si atoms. Both Si–Si bond lengths are 2.35 Å. In the third Si site, Si is bonded in a 9-coordinate geometry to six Ce and three Si atoms.

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Materials Data on Ce2NiGe3 by Materials Project

Ce2NiGe3 is hexagonal omega structure-derived structured and crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded to twelve equivalent Ge atoms to form CeGe12 cuboctahedra that share edges with twelve equivalent CeNi4Ge8 cuboctahedra and faces with eight CeGe12 cuboctahedra. All Ce–Ge bond lengths are 3.24 Å. In the second Ce site, Ce is bonded to four equivalent Ni and eight equivalent Ge atoms to form a mixture of edge and face-sharing CeNi4Ge8 cuboctahedra. All Ce–Ni bond lengths are 3.17 Å. There are four shorter (3.13 Å) and four longer (3.16 Å) Ce–Ge bond lengths. Ni is bonded in a 3-coordinate geometry to six equivalent Ce and three equivalent Ge atoms. All Ni–Ge bond lengths are 2.31 Å. Ge is bonded in a 1-coordinate geometry to six Ce, one Ni, and two equivalent Ge atoms. There are one shorter (2.48 Å) and one longer (2.49 Å) Ge–Ge bond lengths.

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Materials Data on Ce2Zn3Cu7 by Materials Project

Ce2Cu7Zn3 crystallizes in the monoclinic P2/m space group. The structure is three-dimensional. Ce is bonded in a 6-coordinate geometry to twelve Cu and six Zn atoms. There are a spread of Ce–Cu bond distances ranging from 2.91–3.33 Å. There are two shorter (3.29 Å) and four longer (3.32 Å) Ce–Zn bond lengths. There are five inequivalent Cu sites. In the first Cu site, Cu is bonded to four equivalent Ce, six Cu, and two equivalent Zn atoms to form distorted CuCe4Zn2Cu6 cuboctahedra that share corners with six CuCe4Zn2Cu6 cuboctahedra, corners with ten ZnCe4ZnCu7 cuboctahedra, edges with four equivalent CuCe4Zn2Cu6 cuboctahedra, edges with six ZnCe4ZnCu7 cuboctahedra, faces with four equivalent ZnCe4ZnCu7 cuboctahedra, and faces with six CuCe4Zn2Cu6 cuboctahedra. There are four shorter (2.56 Å) and two longer (2.57 Å) Cu–Cu bond lengths. Both Cu–Zn bond lengths are 2.55 Å. In the second Cu site, Cu is bonded to four equivalent Ce, four equivalent Cu, and four Zn atoms to form distorted CuCe4Zn4Cu4 cuboctahedra that share corners with four equivalent ZnCe4ZnCu7 cuboctahedra, corners with twelve CuCe4Zn2Cu6 cuboctahedra, edges with two equivalent CuCe4Zn2Cu6 cuboctahedra, edges with eight ZnCe4ZnCu7 cuboctahedra, faces with four CuCe4Zn2Cu6 cuboctahedra, and faces with six ZnCe4ZnCu7 cuboctahedra. All Cu–Cu bond lengths are 2.54 Å. All Cu–Zn bond lengths are 2.57 Å. In the third Cu site, Cu is bonded to four equivalent Ce, six Cu, and two equivalent Zn atoms to form distorted CuCe4Zn2Cu6 cuboctahedra that share corners with eight CuCe4Zn4Cu4 cuboctahedra, corners with eight ZnCe4ZnCu7 cuboctahedra, edges with four equivalent ZnCe4ZnCu7 cuboctahedra, edges with six CuCe4Zn2Cu6 cuboctahedra, faces with four CuCe4Zn2Cu6 cuboctahedra, and faces with six ZnCe4ZnCu7 cuboctahedra. All Cu–Cu bond lengths are 2.54 Å. Both Cu–Zn bond lengths are 2.54 Å. In the fourth Cu site, Cu is bonded in a 12-coordinate geometry to three equivalent Ce, two equivalent Cu, and four Zn atoms. There are two shorter (2.57 Å) and two longer (2.58 Å) Cu–Zn bond lengths. In the fifth Cu site, Cu is bonded in a 12-coordinate geometry to three equivalent Ce, four Cu, and two equivalent Zn atoms. Both Cu–Zn bond lengths are 2.56 Å. There are two inequivalent Zn sites. In the first Zn site, Zn is bonded to four equivalent Ce, seven Cu, and one Zn atom to form distorted ZnCe4ZnCu7 cuboctahedra that share corners with six CuCe4Zn2Cu6 cuboctahedra, corners with ten ZnCe4ZnCu7 cuboctahedra, edges with four ZnCe4ZnCu7 cuboctahedra, edges with six CuCe4Zn2Cu6 cuboctahedra, faces with four ZnCe4ZnCu7 cuboctahedra, and faces with six CuCe4Zn2Cu6 cuboctahedra. The Zn–Zn bond length is 2.61 Å. In the second Zn site, Zn is bonded to four equivalent Ce, six Cu, and two equivalent Zn atoms to form distorted ZnCe4Zn2Cu6 cuboctahedra that share corners with six ZnCe4ZnCu7 cuboctahedra, corners with ten CuCe4Zn2Cu6 cuboctahedra, edges with four equivalent ZnCe4ZnCu7 cuboctahedra, edges with six CuCe4Zn2Cu6 cuboctahedra, faces with four CuCe4Zn4Cu4 cuboctahedra, and faces with six ZnCe4ZnCu7 cuboctahedra.

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Materials Data on Ce4UO10 by Materials Project

UCe4O10 is Fluorite-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. U6+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All U–O bond lengths are 2.31 Å. There are two inequivalent Ce+3.50+ sites. In the first Ce+3.50+ site, Ce+3.50+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are four shorter (2.32 Å) and four longer (2.44 Å) Ce–O bond lengths. In the second Ce+3.50+ site, Ce+3.50+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are four shorter (2.35 Å) and four longer (2.38 Å) Ce–O bond lengths. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded to two equivalent U6+ and two equivalent Ce+3.50+ atoms to form a mixture of edge and corner-sharing OCe2U2 tetrahedra. In the second O2- site, O2- is bonded to four equivalent Ce+3.50+ atoms to form a mixture of edge and corner-sharing OCe4 tetrahedra. In the third O2- site, O2- is bonded to four Ce+3.50+ atoms to form a mixture of edge and corner-sharing OCe4 tetrahedra.

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Materials Data on CeMg(N3O13)2 by Materials Project

MgO8Ce(NO3)6 is alpha Niobium phosphide-like structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two Ce(NO3)6 clusters and two MgO8 clusters. In each Ce(NO3)6 cluster, Ce is bonded in a cuboctahedral geometry to twelve O atoms. There are a spread of Ce–O bond distances ranging from 2.53–2.62 Å. There are three inequivalent N sites. In the first N site, N is bonded in a trigonal planar geometry to three O atoms. There are a spread of N–O bond distances ranging from 1.23–1.29 Å. In the second N site, N is bonded in a trigonal planar geometry to three O atoms. There are a spread of N–O bond distances ranging from 1.24–1.28 Å. In the third N site, N is bonded in a trigonal planar geometry to three O atoms. There are a spread of N–O bond distances ranging from 1.24–1.29 Å. There are nine inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one Ce and one N atom. In the second O site, O is bonded in a single-bond geometry to one N atom. In the third O site, O is bonded in a distorted single-bond geometry to one Ce and one N atom. In the fourth O site, O is bonded in a distorted single-bond geometry to one Ce and one N atom. In the fifth O site, O is bonded in a distorted single-bond geometry to one Ce and one N atom. In the sixth O site, O is bonded in a single-bond geometry to one N atom. In the seventh O site, O is bonded in a distorted water-like geometry to one Ce and one N atom. In the eighth O site, O is bonded in a single-bond geometry to one N atom. In the ninth O site, O is bonded in a distorted single-bond geometry to one Ce and one N atom. In each MgO8 cluster, Mg is bonded in an octahedral geometry to six O atoms. There are a spread of Mg–O bond distances ranging from 2.08–2.22 Å. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one O atom. The O–O bond length is 1.24 Å. In the second O site, O is bonded in a 2-coordinate geometry to one Mg and one O atom. The O–O bond length is 1.30 Å. In the third O site, O is bonded in a 2-coordinate geometry to one Mg and one O atom. In the fourth O site, O is bonded in a distorted bent 120 degrees geometry to one Mg and one O atom.

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Materials Data on Ce3Th3Si4 by Materials Project

Th3Ce3Si4 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. there are two inequivalent Th sites. In the first Th site, Th is bonded in a 6-coordinate geometry to six Si atoms. There are two shorter (3.07 Å) and four longer (3.13 Å) Th–Si bond lengths. In the second Th site, Th is bonded in a 6-coordinate geometry to six Si atoms. There are two shorter (3.08 Å) and four longer (3.13 Å) Th–Si bond lengths. There are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a distorted rectangular see-saw-like geometry to four Si atoms. There are a spread of Ce–Si bond distances ranging from 3.09–3.15 Å. In the second Ce site, Ce is bonded in a distorted hexagonal planar geometry to six Si atoms. There are two shorter (3.05 Å) and four longer (3.12 Å) Ce–Si bond lengths. There are three inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to six Th, two equivalent Ce, and one Si atom. The Si–Si bond length is 2.50 Å. In the second Si site, Si is bonded in a 9-coordinate geometry to four equivalent Th, four Ce, and one Si atom. In the third Si site, Si is bonded in a 9-coordinate geometry to four Th, four Ce, and one Si atom. The Si–Si bond length is 2.47 Å.

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Materials Data on Ce2CoGe4Ru3 by Materials Project

Ce2Ru3CoGe4 crystallizes in the tetragonal P-4m2 space group. The structure is three-dimensional. Ce is bonded in a 4-coordinate geometry to six Ru, two equivalent Co, and eight Ge atoms. All Ce–Ru bond lengths are 3.28 Å. Both Ce–Co bond lengths are 3.28 Å. There are four shorter (3.24 Å) and four longer (3.26 Å) Ce–Ge bond lengths. There are three inequivalent Ru sites. In the first Ru site, Ru is bonded in a 4-coordinate geometry to four equivalent Ce and four equivalent Ge atoms. All Ru–Ge bond lengths are 2.44 Å. In the second Ru site, Ru is bonded to four equivalent Ce and four equivalent Ge atoms to form distorted RuCe4Ge4 cuboctahedra that share edges with four equivalent RuCe4Ge4 cuboctahedra and faces with four equivalent CoCe4Ge4 cuboctahedra. All Ru–Ge bond lengths are 2.42 Å. In the third Ru site, Ru is bonded in a 4-coordinate geometry to four equivalent Ce and four equivalent Ge atoms. All Ru–Ge bond lengths are 2.44 Å. Co is bonded to four equivalent Ce and four equivalent Ge atoms to form distorted CoCe4Ge4 cuboctahedra that share edges with four equivalent CoCe4Ge4 cuboctahedra and faces with four equivalent RuCe4Ge4 cuboctahedra. All Co–Ge bond lengths are 2.42 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to four equivalent Ce, two equivalent Ru, two equivalent Co, and one Ge atom. The Ge–Ge bond length is 2.60 Å. In the second Ge site, Ge is bonded in a 9-coordinate geometry to four equivalent Ce, four Ru, and one Ge atom.

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