cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1196309
title: Materials Data on GdMg2 by Materials Project

description: Mg2Gd is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Mg is bonded to six equivalent Mg and six equivalent Gd atoms to form a mixture of corner, edge, and face-sharing MgGd6Mg6 cuboctahedra. All Mg–Mg bond lengths are 3.01 Å. All Mg–Gd bond lengths are 3.53 Å. Gd is bonded in a 12-coordinate geometry to twelve equivalent Mg and four equivalent Gd atoms. All Gd–Gd bond lengths are 3.69 Å.
DOI: 10.17188/1196310
title: Materials Data on Hf3Si2 by Materials Project

description: Hf3Si2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 6-coordinate geometry to six equivalent Si atoms. There are two shorter (2.73 Å) and four longer (2.80 Å) Hf–Si bond lengths. In the second Hf site, Hf is bonded in a square co-planar geometry to four equivalent Si atoms. All Hf–Si bond lengths are 2.78 Å. Si is bonded in a 9-coordinate geometry to eight Hf and one Si atom. The Si–Si bond length is 2.46 Å.
DOI: 10.17188/1196311
title: Materials Data on UFe2 by Materials Project

description: UFe2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. U is bonded in a 12-coordinate geometry to four equivalent U and twelve equivalent Fe atoms. All U–U bond lengths are 3.02 Å. All U–Fe bond lengths are 2.89 Å. Fe is bonded to six equivalent U and six equivalent Fe atoms to form a mixture of corner, edge, and face-sharing FeU6Fe6 cuboctahedra. All Fe–Fe bond lengths are 2.47 Å.
DOI: 10.17188/1196312
title: Materials Data on EuInPt by Materials Project

description: EuPtIn crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Eu is bonded in a 5-coordinate geometry to five equivalent Pt and six equivalent In atoms. There are a spread of Eu–Pt bond distances ranging from 3.13–3.22 Å. There are a spread of Eu–In bond distances ranging from 3.42–3.54 Å. Pt is bonded in a 9-coordinate geometry to five equivalent Eu and four equivalent In atoms. There are a spread of Pt–In bond distances ranging from 2.83–2.86 Å. In is bonded in a 4-coordinate geometry to six equivalent Eu and four equivalent Pt atoms.
DOI: 10.17188/1196313
title: Materials Data on Tb2InPd2 by Materials Project

description: Tb2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Tb is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.87 Å) and four longer (3.02 Å) Tb–Pd bond lengths. All Tb–In bond lengths are 3.43 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Tb, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.80 Å. Both Pd–In bond lengths are 3.05 Å. In is bonded to eight equivalent Tb and four equivalent Pd atoms to form a mixture of corner and face-sharing InTb8Pd4 cuboctahedra.
DOI: 10.17188/1196314
title: Materials Data on U(FeP3)4 by Materials Project

description: UFe4P12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. U3+ is bonded to twelve equivalent P1- atoms to form UP12 cuboctahedra that share faces with eight equivalent FeP6 octahedra. All U–P bond lengths are 2.96 Å. Fe+2.25+ is bonded to six equivalent P1- atoms to form FeP6 octahedra that share corners with six equivalent FeP6 octahedra and faces with two equivalent UP12 cuboctahedra. The corner-sharing octahedral tilt angles are 58°. All Fe–P bond lengths are 2.23 Å. P1- is bonded in a distorted bent 120 degrees geometry to one U3+, two equivalent Fe+2.25+, and two equivalent P1- atoms. Both P–P bond lengths are 2.35 Å.
DOI: 10.17188/1196315
title: Materials Data on PrSnPd by Materials Project

description: PrPdSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Pr is bonded in a 11-coordinate geometry to five Pd and six equivalent Sn atoms. There are four shorter (3.12 Å) and one longer (3.17 Å) Pr–Pd bond lengths. There are two shorter (3.33 Å) and four longer (3.46 Å) Pr–Sn bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 9-coordinate geometry to six equivalent Pr and three equivalent Sn atoms. All Pd–Sn bond lengths are 2.94 Å. In the second Pd site, Pd is bonded in a 9-coordinate geometry to three equivalent Pr and six equivalent Sn atoms. All Pd–Sn bond lengths are 2.84 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Pr and four Pd atoms.
DOI: 10.17188/1196316
title: Materials Data on CeGe2 by Materials Project

description: CeGe2 is hexagonal omega structure-like structured and crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Ce is bonded to twelve Ge atoms to form a mixture of edge and face-sharing CeGe12 cuboctahedra. There are a spread of Ce–Ge bond distances ranging from 3.20–3.41 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six equivalent Ce and three Ge atoms. There are two shorter (2.51 Å) and one longer (2.56 Å) Ge–Ge bond lengths. In the second Ge site, Ge is bonded in a 9-coordinate geometry to six equivalent Ce and three Ge atoms. Both Ge–Ge bond lengths are 2.50 Å.
DOI: 10.17188/1196317
title: Materials Data on La(GePt)2 by Materials Project

description: LaPt2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eight equivalent Pt and eight equivalent Ge atoms. All La–Pt bond lengths are 3.37 Å. All La–Ge bond lengths are 3.41 Å. Pt is bonded in a 4-coordinate geometry to four equivalent La and four equivalent Ge atoms. All Pt–Ge bond lengths are 2.55 Å. Ge is bonded in a 9-coordinate geometry to four equivalent La, four equivalent Pt, and one Ge atom. The Ge–Ge bond length is 2.58 Å.
DOI: 10.17188/1196318
title: Materials Data on Mn3InC by Materials Project

description: Mn3InC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one methane molecule and one InMn3 framework. In the InMn3 framework, Mn is bonded in a linear geometry to two equivalent In atoms. Both Mn–In bond lengths are 2.54 Å. In is bonded to six equivalent Mn atoms to form corner-sharing InMn6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196319
title: Materials Data on GdSbPd by Materials Project

description: GdPdSb crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Gd is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Sb atoms. There are three shorter (2.98 Å) and three longer (3.62 Å) Gd–Pd bond lengths. There are three shorter (3.17 Å) and three longer (3.37 Å) Gd–Sb bond lengths. Pd is bonded in a 10-coordinate geometry to six equivalent Gd and four equivalent Sb atoms. There are three shorter (2.77 Å) and one longer (3.03 Å) Pd–Sb bond lengths. Sb is bonded in a 10-coordinate geometry to six equivalent Gd and four equivalent Pd atoms.
DOI: 10.17188/1196320
title: Materials Data on YbMnGe by Materials Project

description: YbMnGe crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Yb is bonded in a 5-coordinate geometry to five Ge atoms. There are one shorter (2.96 Å) and four longer (2.99 Å) Yb–Ge bond lengths. Mn is bonded in a 4-coordinate geometry to four Ge atoms. There are two shorter (2.70 Å) and two longer (2.71 Å) Mn–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six equivalent Yb and three equivalent Mn atoms. In the second Ge site, Ge is bonded in a distorted q6 geometry to three equivalent Yb and six equivalent Mn atoms.
DOI: 10.17188/1196321
title: Materials Data on U4S3 by Materials Project

description: U4S3 crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a square co-planar geometry to four equivalent S atoms. All U–S bond lengths are 2.71 Å. In the second U site, U is bonded to six equivalent S atoms to form corner-sharing US6 octahedra. The corner-sharing octahedral tilt angles are 0°. All U–S bond lengths are 2.71 Å. S is bonded to six U atoms to form a mixture of edge and corner-sharing SU6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196322
title: Materials Data on EuNi2B2C by Materials Project

description: EuNi2B2C crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Eu2+ is bonded in a square co-planar geometry to four equivalent C4- atoms. All Eu–C bond lengths are 2.59 Å. Ni1+ is bonded to four equivalent B atoms to form NiB4 tetrahedra that share corners with four equivalent CEu4B2 octahedra, corners with four equivalent NiB4 tetrahedra, and edges with four equivalent NiB4 tetrahedra. The corner-sharing octahedral tilt angles are 61°. All Ni–B bond lengths are 2.10 Å. B is bonded in a distorted single-bond geometry to four equivalent Ni1+ and one C4- atom. The B–C bond length is 1.48 Å. C4- is bonded to four equivalent Eu2+ and two equivalent B atoms to form distorted CEu4B2 octahedra that share corners with four equivalent CEu4B2 octahedra, corners with eight equivalent NiB4 tetrahedra, and edges with four equivalent CEu4B2 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196344
title: Materials Data on SiP2 by Materials Project

description: SiP2 is Pyrite structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Si4- is bonded to six equivalent P2+ atoms to form corner-sharing SiP6 octahedra. The corner-sharing octahedral tilt angles are 65°. All Si–P bond lengths are 2.41 Å. P2+ is bonded in a trigonal non-coplanar geometry to three equivalent Si4- atoms.
DOI: 10.17188/1196345
title: Materials Data on TaMnP by Materials Project

description: TaMnP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ta is bonded in a 5-coordinate geometry to five equivalent P atoms. There are two shorter (2.60 Å) and three longer (2.62 Å) Ta–P bond lengths. Mn is bonded to four equivalent P atoms to form a mixture of distorted corner and edge-sharing MnP4 tetrahedra. There are a spread of Mn–P bond distances ranging from 2.27–2.37 Å. P is bonded in a 9-coordinate geometry to five equivalent Ta and four equivalent Mn atoms.
DOI: 10.17188/1196346
title: Materials Data on ScInCu2 by Materials Project

description: ScCu2In 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 eight equivalent Cu and six equivalent In atoms. All Sc–Cu bond lengths are 2.78 Å. All Sc–In bond lengths are 3.21 Å. Cu is bonded in a body-centered cubic geometry to four equivalent Sc and four equivalent In atoms. All Cu–In bond lengths are 2.78 Å. In is bonded in a distorted body-centered cubic geometry to six equivalent Sc and eight equivalent Cu atoms.
DOI: 10.17188/1196347
title: Materials Data on CaIn2 by Materials Project

description: CaIn2 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ca is bonded in a 12-coordinate geometry to twelve equivalent In atoms. There are six shorter (3.27 Å) and six longer (3.69 Å) Ca–In bond lengths. In is bonded in a 10-coordinate geometry to six equivalent Ca and four equivalent In atoms. There are three shorter (2.96 Å) and one longer (3.15 Å) In–In bond lengths.
DOI: 10.17188/1196348
title: Materials Data on YSiRu by Materials Project

description: YRuSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Y is bonded in a 9-coordinate geometry to four equivalent Ru and five equivalent Si atoms. There are a spread of Y–Ru bond distances ranging from 2.96–2.98 Å. There are two shorter (3.00 Å) and three longer (3.04 Å) Y–Si bond lengths. Ru is bonded in a 8-coordinate geometry to four equivalent Y and four equivalent Si atoms. There are a spread of Ru–Si bond distances ranging from 2.47–2.58 Å. Si is bonded in a 10-coordinate geometry to five equivalent Y and four equivalent Ru atoms.
DOI: 10.17188/1196349
title: Materials Data on Nd(GePt)2 by Materials Project

description: Nd(PtGe)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Nd is bonded in a 8-coordinate geometry to eight equivalent Pt and eight equivalent Ge atoms. All Nd–Pt bond lengths are 3.34 Å. All Nd–Ge bond lengths are 3.37 Å. Pt is bonded in a 4-coordinate geometry to four equivalent Nd and four equivalent Ge atoms. All Pt–Ge bond lengths are 2.54 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Nd, four equivalent Pt, and one Ge atom. The Ge–Ge bond length is 2.52 Å.
DOI: 10.17188/1196350
title: Materials Data on Eu2SO2 by Materials Project

description: Eu2O2S crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Eu3+ is bonded in a 7-coordinate geometry to three equivalent S2- and four equivalent O2- atoms. All Eu–S bond lengths are 2.97 Å. There are three shorter (2.34 Å) and one longer (2.39 Å) Eu–O bond lengths. S2- is bonded to six equivalent Eu3+ atoms to form distorted SEu6 octahedra that share corners with twelve equivalent OEu4 tetrahedra, edges with six equivalent SEu6 octahedra, and edges with six equivalent OEu4 tetrahedra. O2- is bonded to four equivalent Eu3+ atoms to form OEu4 tetrahedra that share corners with six equivalent SEu6 octahedra, corners with six equivalent OEu4 tetrahedra, edges with three equivalent SEu6 octahedra, and edges with three equivalent OEu4 tetrahedra. The corner-sharing octahedra tilt angles range from 26–50°.
DOI: 10.17188/1196351
title: Materials Data on HoGeIr by Materials Project

description: HoIrGe crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ho is bonded in a 11-coordinate geometry to six equivalent Ir and five equivalent Ge atoms. There are a spread of Ho–Ir bond distances ranging from 3.03–3.29 Å. There are two shorter (2.98 Å) and three longer (3.02 Å) Ho–Ge bond lengths. Ir is bonded in a 10-coordinate geometry to six equivalent Ho and four equivalent Ge atoms. There are three shorter (2.56 Å) and one longer (2.63 Å) Ir–Ge bond lengths. Ge is bonded in a 9-coordinate geometry to five equivalent Ho and four equivalent Ir atoms.
DOI: 10.17188/1196352
title: Materials Data on HfC by Materials Project

description: HfC is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hf4+ is bonded to six equivalent C4- atoms to form a mixture of corner and edge-sharing HfC6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Hf–C bond lengths are 2.33 Å. C4- is bonded to six equivalent Hf4+ atoms to form a mixture of corner and edge-sharing CHf6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196353
title: Materials Data on EuRh3C by Materials Project

description: EuRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Eu is bonded to twelve equivalent Rh atoms to form EuRh12 cuboctahedra that share corners with twelve equivalent EuRh12 cuboctahedra, faces with six equivalent EuRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Eu–Rh bond lengths are 2.99 Å. Rh is bonded to four equivalent Eu and two equivalent C atoms to form a mixture of distorted edge, corner, and face-sharing RhEu4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.11 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent EuRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196354
title: Materials Data on LaNiGe2 by Materials Project

description: LaNiGe2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. La is bonded in a 10-coordinate geometry to four equivalent Ni and ten Ge atoms. All La–Ni bond lengths are 3.28 Å. There are a spread of La–Ge bond distances ranging from 3.21–3.37 Å. Ni is bonded in a 5-coordinate geometry to four equivalent La and five Ge atoms. There are a spread of Ni–Ge bond distances ranging from 2.36–2.45 Å. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 8-coordinate geometry to four equivalent La and four equivalent Ni atoms. In the second Ge site, Ge is bonded in a 1-coordinate geometry to six equivalent La, one Ni, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.59 Å.
DOI: 10.17188/1196355
title: Materials Data on Fe3Ge by Materials Project

description: Fe3Ge is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are three inequivalent Fe sites. In the first Fe site, Fe is bonded to eight Fe and four equivalent Ge atoms to form FeFe8Ge4 cuboctahedra that share corners with four equivalent GeFe12 cuboctahedra, corners with fourteen FeFe8Ge4 cuboctahedra, edges with six equivalent GeFe12 cuboctahedra, edges with twelve FeFe8Ge4 cuboctahedra, faces with four equivalent GeFe12 cuboctahedra, and faces with sixteen FeFe8Ge4 cuboctahedra. There are a spread of Fe–Fe bond distances ranging from 2.51–2.64 Å. There are two shorter (2.57 Å) and two longer (2.60 Å) Fe–Ge bond lengths. In the second Fe site, Fe is bonded to eight Fe and four equivalent Ge atoms to form FeFe8Ge4 cuboctahedra that share corners with four equivalent GeFe12 cuboctahedra, corners with fourteen FeFe8Ge4 cuboctahedra, edges with six equivalent GeFe12 cuboctahedra, edges with twelve FeFe8Ge4 cuboctahedra, faces with four equivalent GeFe12 cuboctahedra, and faces with sixteen FeFe8Ge4 cuboctahedra. There are one shorter (2.51 Å) and one longer (2.64 Å) Fe–Fe bond lengths. There are two shorter (2.57 Å) and two longer (2.60 Å) Fe–Ge bond lengths. In the third Fe site, Fe is bonded to eight Fe and four equivalent Ge atoms to form FeFe8Ge4 cuboctahedra that share corners with four equivalent GeFe12 cuboctahedra, corners with fourteen FeFe8Ge4 cuboctahedra, edges with six equivalent GeFe12 cuboctahedra, edges with twelve FeFe8Ge4 cuboctahedra, faces with four equivalent GeFe12 cuboctahedra, and faces with sixteen FeFe8Ge4 cuboctahedra. There are two shorter (2.57 Å) and two longer (2.60 Å) Fe–Ge bond lengths. Ge is bonded to twelve Fe atoms to form GeFe12 cuboctahedra that share corners with six equivalent GeFe12 cuboctahedra, corners with twelve FeFe8Ge4 cuboctahedra, edges with eighteen FeFe8Ge4 cuboctahedra, faces with eight equivalent GeFe12 cuboctahedra, and faces with twelve FeFe8Ge4 cuboctahedra.
DOI: 10.17188/1196356
title: Materials Data on Tb(GeRu)2 by Materials Project

description: TbRu2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Tb is bonded in a 8-coordinate geometry to eight equivalent Ru and eight equivalent Ge atoms. All Tb–Ru bond lengths are 3.27 Å. All Tb–Ge bond lengths are 3.28 Å. Ru is bonded in a 4-coordinate geometry to four equivalent Tb and four equivalent Ge atoms. All Ru–Ge bond lengths are 2.44 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Tb, four equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.58 Å.
DOI: 10.17188/1196357
title: Materials Data on Ti5Si3 by Materials Project

description: Ti5Si3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Ti+2.40+ sites. In the first Ti+2.40+ site, Ti+2.40+ is bonded in a 6-coordinate geometry to six equivalent Si4- atoms. All Ti–Si bond lengths are 2.64 Å. In the second Ti+2.40+ site, Ti+2.40+ is bonded to five equivalent Si4- atoms to form a mixture of distorted edge and corner-sharing TiSi5 trigonal bipyramids. There are a spread of Ti–Si bond distances ranging from 2.57–2.78 Å. Si4- is bonded in a 9-coordinate geometry to nine Ti+2.40+ atoms.
DOI: 10.17188/1196358
title: Materials Data on La(NiSn)2 by Materials Project

description: LaNi2Sn2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eight equivalent Ni and eight equivalent Sn atoms. All La–Ni bond lengths are 3.45 Å. All La–Sn bond lengths are 3.48 Å. Ni is bonded in a 4-coordinate geometry to four equivalent La and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.53 Å. Sn is bonded in a 9-coordinate geometry to four equivalent La, four equivalent Ni, and one Sn atom. The Sn–Sn bond length is 2.90 Å.
DOI: 10.17188/1196359
title: Materials Data on ScNiB4 by Materials Project

description: ScNiB4 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. Sc3+ is bonded in a 4-coordinate geometry to fourteen B+1.50- atoms. There are a spread of Sc–B bond distances ranging from 2.48–2.65 Å. Ni3+ is bonded in a 10-coordinate geometry to ten B+1.50- atoms. There are a spread of Ni–B bond distances ranging from 2.15–2.25 Å. There are four inequivalent B+1.50- sites. In the first B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to four equivalent Sc3+, two equivalent Ni3+, and three B+1.50- atoms. There are a spread of B–B bond distances ranging from 1.73–1.79 Å. In the second B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to four equivalent Sc3+, two equivalent Ni3+, and three B+1.50- atoms. Both B–B bond lengths are 1.71 Å. In the third B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to two equivalent Sc3+, four equivalent Ni3+, and three B+1.50- atoms. There is one shorter (1.72 Å) and one longer (1.74 Å) B–B bond length. In the fourth B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to four equivalent Sc3+, two equivalent Ni3+, and three B+1.50- atoms.
DOI: 10.17188/1196360
title: Materials Data on Dy(GeRu)2 by Materials Project

description: DyRu2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Dy is bonded in a 8-coordinate geometry to eight equivalent Ru and eight equivalent Ge atoms. All Dy–Ru bond lengths are 3.27 Å. All Dy–Ge bond lengths are 3.28 Å. Ru is bonded in a 4-coordinate geometry to four equivalent Dy and four equivalent Ge atoms. All Ru–Ge bond lengths are 2.44 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Dy, four equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.57 Å.
DOI: 10.17188/1196361
title: Materials Data on In6Ga2PtO8 by Materials Project

description: PtIn6Ga2O8 is Aluminum carbonitride-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pt2- is bonded to six equivalent In2+ atoms to form PtIn6 octahedra that share corners with twenty-four equivalent OIn3Ga tetrahedra. All Pt–In bond lengths are 2.57 Å. In2+ is bonded in a 5-coordinate geometry to one Pt2- and four equivalent O2- atoms. All In–O bond lengths are 2.30 Å. Ga3+ is bonded in a tetrahedral geometry to four equivalent O2- atoms. All Ga–O bond lengths are 1.91 Å. O2- is bonded to three equivalent In2+ and one Ga3+ atom to form distorted OIn3Ga tetrahedra that share corners with three equivalent PtIn6 octahedra, corners with six equivalent OIn3Ga tetrahedra, and edges with three equivalent OIn3Ga tetrahedra. The corner-sharing octahedral tilt angles are 62°.
DOI: 10.17188/1196362
title: Materials Data on PuPd3 by Materials Project

description: PuPd3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pu is bonded to twelve equivalent Pd atoms to form a mixture of face and corner-sharing PuPd12 cuboctahedra. All Pu–Pd bond lengths are 2.94 Å. Pd is bonded in a distorted square co-planar geometry to four equivalent Pu atoms.