cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1197221
title: Materials Data on Ce(FeGe)2 by Materials Project

description: CeFe2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Fe and eight equivalent Ge atoms. All Ce–Fe bond lengths are 3.21 Å. All Ce–Ge bond lengths are 3.19 Å. Fe is bonded in a 4-coordinate geometry to four equivalent Ce and four equivalent Ge atoms. All Fe–Ge bond lengths are 2.34 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Ce, four equivalent Fe, and one Ge atom. The Ge–Ge bond length is 2.67 Å.
DOI: 10.17188/1197222
title: Materials Data on VGaFe2 by Materials Project

description: Fe2VGa is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. V is bonded in a distorted body-centered cubic geometry to eight equivalent Fe and six equivalent Ga atoms. All V–Fe bond lengths are 2.48 Å. All V–Ga bond lengths are 2.86 Å. Fe is bonded in a distorted body-centered cubic geometry to four equivalent V and four equivalent Ga atoms. All Fe–Ga bond lengths are 2.48 Å. Ga is bonded in a distorted body-centered cubic geometry to six equivalent V and eight equivalent Fe atoms.
DOI: 10.17188/1197223
title: Materials Data on EuGa4 by Materials Project

description: EuGa4 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Eu is bonded in a 8-coordinate geometry to sixteen Ga atoms. There are eight shorter (3.39 Å) and eight longer (3.48 Å) Eu–Ga bond lengths. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded in a 9-coordinate geometry to four equivalent Eu and five Ga atoms. There are one shorter (2.51 Å) and four longer (2.64 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 12-coordinate geometry to four equivalent Eu and four equivalent Ga atoms.
DOI: 10.17188/1197224
title: Materials Data on Ca2InPt2 by Materials Project

description: Ca2Pt2In crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Ca is bonded in a 7-coordinate geometry to six equivalent Pt and four equivalent In atoms. There are a spread of Ca–Pt bond distances ranging from 3.05–3.23 Å. There are a spread of Ca–In bond distances ranging from 3.41–3.46 Å. Pt is bonded in a 9-coordinate geometry to six equivalent Ca, one Pt, and two equivalent In atoms. The Pt–Pt bond length is 2.65 Å. There are one shorter (2.74 Å) and one longer (2.76 Å) Pt–In bond lengths. In is bonded in a 12-coordinate geometry to eight equivalent Ca and four equivalent Pt atoms.
DOI: 10.17188/1197225
title: Materials Data on NdInPd by Materials Project

description: NdPdIn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Nd is bonded in a 11-coordinate geometry to five Pd and six equivalent In atoms. There are four shorter (3.10 Å) and one longer (3.22 Å) Nd–Pd bond lengths. There are two shorter (3.30 Å) and four longer (3.45 Å) Nd–In bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 9-coordinate geometry to six equivalent Nd and three equivalent In atoms. All Pd–In bond lengths are 2.97 Å. In the second Pd site, Pd is bonded in a 9-coordinate geometry to three equivalent Nd and six equivalent In atoms. All Pd–In bond lengths are 2.82 Å. In is bonded in a 10-coordinate geometry to six equivalent Nd and four Pd atoms.
DOI: 10.17188/1197226
title: Materials Data on Tm3SnC by Materials Project

description: Tm3SnC 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 Tm3Sn framework. In the Tm3Sn framework, Tm is bonded in a linear geometry to two equivalent Sn atoms. Both Tm–Sn bond lengths are 2.76 Å. Sn is bonded to six equivalent Tm atoms to form corner-sharing SnTm6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1197227
title: Materials Data on Th(GePt)2 by Materials Project

description: Th(PtGe)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Th is bonded in a 8-coordinate geometry to eight equivalent Pt and eight equivalent Ge atoms. All Th–Pt bond lengths are 3.34 Å. All Th–Ge bond lengths are 3.36 Å. Pt is bonded in a 4-coordinate geometry to four equivalent Th 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 Th, four equivalent Pt, and one Ge atom. The Ge–Ge bond length is 2.47 Å.
DOI: 10.17188/1197229
title: Materials Data on NdCoSi by Materials Project

description: NdCoSi is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Nd3+ is bonded in a 5-coordinate geometry to five equivalent Si4- atoms. There are four shorter (3.02 Å) and one longer (3.71 Å) Nd–Si bond lengths. Co1+ is bonded to four equivalent Si4- atoms to form a mixture of corner and edge-sharing CoSi4 tetrahedra. All Co–Si bond lengths are 2.33 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Nd3+ and four equivalent Co1+ atoms.
DOI: 10.17188/1197230
title: Materials Data on PrSi2Mo2C by Materials Project

description: PrMo2Si2C crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Pr3+ is bonded in a distorted linear geometry to eight equivalent Si4- and two equivalent C4- atoms. All Pr–Si bond lengths are 3.23 Å. Both Pr–C bond lengths are 2.72 Å. Mo+4.50+ is bonded to four equivalent Si4- and two equivalent C4- atoms to form a mixture of distorted face, edge, and corner-sharing MoSi4C2 octahedra. The corner-sharing octahedral tilt angles are 0°. All Mo–Si bond lengths are 2.60 Å. Both Mo–C bond lengths are 2.12 Å. Si4- is bonded in a 9-coordinate geometry to four equivalent Pr3+, four equivalent Mo+4.50+, and one Si4- atom. The Si–Si bond length is 2.42 Å. C4- is bonded to two equivalent Pr3+ and four equivalent Mo+4.50+ atoms to form corner-sharing CPr2Mo4 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1197231
title: Materials Data on Al2PbO4 by Materials Project

description: PbAl2O4 crystallizes in the orthorhombic Ama2 space group. The structure is three-dimensional. Al3+ is bonded to four O2- atoms to form corner-sharing AlO4 tetrahedra. There are a spread of Al–O bond distances ranging from 1.76–1.79 Å. Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.33–2.84 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent Al3+ and one Pb2+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Al3+ and two equivalent Pb2+ atoms. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one Pb2+ atom.
DOI: 10.17188/1197232
title: Materials Data on MnTe2 by Materials Project

description: MnTe2 is Pyrite structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Mn4+ is bonded to six equivalent Te2- atoms to form corner-sharing MnTe6 octahedra. The corner-sharing octahedral tilt angles are 62°. All Mn–Te bond lengths are 2.76 Å. Te2- is bonded in a distorted trigonal planar geometry to three equivalent Mn4+ atoms.
DOI: 10.17188/1197233
title: Materials Data on LiSn4Ir by Materials Project

description: LiIrSn4 is Khatyrkite-derived structured and crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Li is bonded in a q6 geometry to two equivalent Ir and eight equivalent Sn atoms. Both Li–Ir bond lengths are 2.88 Å. All Li–Sn bond lengths are 2.96 Å. Ir is bonded in a distorted q6 geometry to two equivalent Li and eight equivalent Sn atoms. All Ir–Sn bond lengths are 2.84 Å. Sn is bonded in a 2-coordinate geometry to two equivalent Li and two equivalent Ir atoms.
DOI: 10.17188/1197234
title: Materials Data on Na15Pb4 by Materials Project

description: Na15Pb4 crystallizes in the cubic I-43d space group. The structure is three-dimensional. there are two inequivalent Na sites. In the first Na site, Na is bonded to eight equivalent Na and four equivalent Pb atoms to form distorted NaNa8Pb4 cuboctahedra that share corners with eight equivalent PbNa12 cuboctahedra, edges with eight equivalent NaNa8Pb4 cuboctahedra, and faces with four equivalent PbNa12 cuboctahedra. There are four shorter (3.43 Å) and four longer (3.50 Å) Na–Na bond lengths. All Na–Pb bond lengths are 3.60 Å. In the second Na site, Na is bonded in a 3-coordinate geometry to two equivalent Na and three equivalent Pb atoms. There are a spread of Na–Pb bond distances ranging from 3.28–3.56 Å. Pb is bonded to twelve Na atoms to form distorted PbNa12 cuboctahedra that share corners with six equivalent NaNa8Pb4 cuboctahedra, edges with six equivalent PbNa12 cuboctahedra, faces with three equivalent NaNa8Pb4 cuboctahedra, and faces with five equivalent PbNa12 cuboctahedra.
DOI: 10.17188/1197235
title: Materials Data on YbIn4Pt by Materials Project

description: YbPtIn4 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb is bonded in a 7-coordinate geometry to two equivalent Pt and eleven In atoms. Both Yb–Pt bond lengths are 3.26 Å. There are a spread of Yb–In bond distances ranging from 3.26–3.69 Å. Pt is bonded in a 9-coordinate geometry to two equivalent Yb and seven In atoms. There are a spread of Pt–In bond distances ranging from 2.75–2.83 Å. There are three inequivalent In sites. In the first In site, In is bonded in a distorted q6 geometry to four equivalent Yb and six In atoms. There are two shorter (3.07 Å) and four longer (3.14 Å) In–In bond lengths. In the second In site, In is bonded in a 2-coordinate geometry to one Yb, one Pt, and four equivalent In atoms. In the third In site, In is bonded in a 3-coordinate geometry to three equivalent Yb, three equivalent Pt, and one In atom.
DOI: 10.17188/1197236
title: Materials Data on SrTbO3 by Materials Project

description: SrTbO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sr–O bond distances ranging from 2.52–3.13 Å. Tb4+ is bonded to six O2- atoms to form corner-sharing TbO6 octahedra. The corner-sharing octahedra tilt angles range from 34–39°. There are four shorter (2.27 Å) and two longer (2.28 Å) Tb–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+ and two equivalent Tb4+ atoms. In the second O2- site, O2- is bonded to two equivalent Sr2+ and two equivalent Tb4+ atoms to form distorted corner-sharing OSr2Tb2 tetrahedra.
DOI: 10.17188/1197237
title: Materials Data on UZnNi4 by Materials Project

description: UNi4Zn is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. U is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent Zn atoms. All U–Ni bond lengths are 2.84 Å. All U–Zn bond lengths are 2.96 Å. Ni is bonded to three equivalent U, six equivalent Ni, and three equivalent Zn atoms to form a mixture of corner, edge, and face-sharing NiU3Zn3Ni6 cuboctahedra. There are three shorter (2.40 Å) and three longer (2.44 Å) Ni–Ni bond lengths. All Ni–Zn bond lengths are 2.84 Å. Zn is bonded in a 12-coordinate geometry to four equivalent U and twelve equivalent Ni atoms.
DOI: 10.17188/1197238
title: Materials Data on MoP by Materials Project

description: MoP is Tungsten Carbide structured and crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Mo3+ is bonded to six equivalent P3- atoms to form a mixture of distorted corner, edge, and face-sharing MoP6 pentagonal pyramids. All Mo–P bond lengths are 2.46 Å. P3- is bonded to six equivalent Mo3+ atoms to form a mixture of distorted corner, edge, and face-sharing PMo6 pentagonal pyramids.
DOI: 10.17188/1197239
title: Materials Data on Ce(SiIr)2 by Materials Project

description: CeIr2Si2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Ce is bonded in a 4-coordinate geometry to eight Ir and eight Si atoms. There are four shorter (3.16 Å) and four longer (3.29 Å) Ce–Ir bond lengths. There are four shorter (3.19 Å) and four longer (3.20 Å) Ce–Si bond lengths. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 9-coordinate geometry to four equivalent Ce and five Si atoms. There are one shorter (2.41 Å) and four longer (2.43 Å) Ir–Si bond lengths. In the second Ir site, Ir is bonded to four equivalent Ce and four equivalent Si atoms to form a mixture of distorted edge and face-sharing IrCe4Si4 tetrahedra. All Ir–Si bond lengths are 2.45 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded in a 9-coordinate geometry to four equivalent Ce and five Ir atoms. In the second Si site, Si is bonded in a 4-coordinate geometry to four equivalent Ce and four equivalent Ir atoms.
DOI: 10.17188/1197240
title: Materials Data on SrIn4Ir by Materials Project

description: SrIrIn4 crystallizes in the orthorhombic Pmma space group. The structure is three-dimensional. Sr is bonded in a 1-coordinate geometry to one Ir and twelve In atoms. The Sr–Ir bond length is 3.23 Å. There are a spread of Sr–In bond distances ranging from 3.43–3.77 Å. Ir is bonded in a 9-coordinate geometry to one Sr and eight In atoms. There are a spread of Ir–In bond distances ranging from 2.63–2.92 Å. There are three inequivalent In sites. In the first In site, In is bonded in a 2-coordinate geometry to four equivalent Sr, two equivalent Ir, and six In atoms. There are a spread of In–In bond distances ranging from 3.20–3.40 Å. In the second In site, In is bonded in a distorted rectangular see-saw-like geometry to two equivalent Sr, two equivalent Ir, and four equivalent In atoms. In the third In site, In is bonded in a linear geometry to two equivalent Sr, two equivalent Ir, and four equivalent In atoms.
DOI: 10.17188/1197241
title: Materials Data on Th2FeB10 by Materials Project

description: Th2FeB10 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. Th is bonded in a 4-coordinate geometry to two equivalent Fe and twenty B atoms. Both Th–Fe bond lengths are 3.04 Å. There are a spread of Th–B bond distances ranging from 2.87–3.07 Å. Fe is bonded in a 12-coordinate geometry to four equivalent Th and eight B atoms. There are a spread of Fe–B bond distances ranging from 2.12–2.15 Å. There are four inequivalent B sites. In the first B site, B is bonded in a 9-coordinate geometry to four equivalent Th, one Fe, and four B atoms. There are a spread of B–B bond distances ranging from 1.69–1.78 Å. In the second B site, B is bonded in a 1-coordinate geometry to four equivalent Th and five B atoms. There are a spread of B–B bond distances ranging from 1.67–1.77 Å. In the third B site, B is bonded in a 9-coordinate geometry to four equivalent Th, one Fe, and four B atoms. There is one shorter (1.68 Å) and one longer (1.77 Å) B–B bond length. In the fourth B site, B is bonded in a 7-coordinate geometry to four equivalent Th, one Fe, and four B atoms.
DOI: 10.17188/1197242
title: Materials Data on KEuGeS4 by Materials Project

description: KEuGeS4 crystallizes in the monoclinic P2_1 space group. The structure is three-dimensional. K1+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of K–S bond distances ranging from 3.35–3.64 Å. Eu3+ is bonded to seven S2- atoms to form distorted EuS7 pentagonal bipyramids that share corners with two equivalent EuS7 pentagonal bipyramids, a cornercorner with one GeS4 tetrahedra, edges with two equivalent EuS7 pentagonal bipyramids, and edges with three equivalent GeS4 tetrahedra. There are a spread of Eu–S bond distances ranging from 2.90–3.03 Å. Ge4+ is bonded to four S2- atoms to form GeS4 tetrahedra that share a cornercorner with one EuS7 pentagonal bipyramid and edges with three equivalent EuS7 pentagonal bipyramids. There are a spread of Ge–S bond distances ranging from 2.20–2.24 Å. There are four inequivalent S2- sites. In the first S2- site, S2- is bonded in a distorted see-saw-like geometry to one K1+, two equivalent Eu3+, and one Ge4+ atom. In the second S2- site, S2- is bonded to three equivalent K1+, one Eu3+, and one Ge4+ atom to form a mixture of distorted edge and corner-sharing SK3EuGe trigonal bipyramids. In the third S2- site, S2- is bonded in a 5-coordinate geometry to two equivalent K1+, two equivalent Eu3+, and one Ge4+ atom. In the fourth S2- site, S2- is bonded in a 5-coordinate geometry to two equivalent K1+, two equivalent Eu3+, and one Ge4+ atom.
DOI: 10.17188/1197243
title: Materials Data on PbS2O3 by Materials Project

description: PbS2O3 crystallizes in the orthorhombic Pbca space group. The structure is two-dimensional and consists of eight hydrogen sulfide molecules and two PbSO3 sheets oriented in the (0, 0, 1) direction. In each PbSO3 sheet, Pb2+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Pb–O bond distances ranging from 2.66–3.25 Å. S2+ is bonded in a trigonal non-coplanar geometry to three O2- atoms. There is one shorter (1.47 Å) and two longer (1.49 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Pb2+ and one S2+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Pb2+ and one S2+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Pb2+ and one S2+ atom.
DOI: 10.17188/1197245
title: Materials Data on NbSiAs by Materials Project

description: NbSiAs is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Nb5+ is bonded in a 9-coordinate geometry to four equivalent Si4- and five equivalent As1- atoms. All Nb–Si bond lengths are 2.68 Å. There are four shorter (2.71 Å) and one longer (2.85 Å) Nb–As bond lengths. Si4- is bonded to four equivalent Nb5+ and four equivalent Si4- atoms to form a mixture of distorted corner, edge, and face-sharing SiNb4Si4 hexagonal bipyramids. All Si–Si bond lengths are 2.49 Å. As1- is bonded in a 5-coordinate geometry to five equivalent Nb5+ atoms.
DOI: 10.17188/1197246
title: Materials Data on ErSb by Materials Project

description: ErSb is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Er3+ is bonded to six equivalent Sb3- atoms to form a mixture of edge and corner-sharing ErSb6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Er–Sb bond lengths are 3.08 Å. Sb3- is bonded to six equivalent Er3+ atoms to form a mixture of edge and corner-sharing SbEr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1197247
title: Materials Data on Nd3AlN by Materials Project

description: (Nd3Al)2N2 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Nd3Al framework. In the Nd3Al framework, Nd is bonded in a linear geometry to two equivalent Al atoms. Both Nd–Al bond lengths are 2.77 Å. Al is bonded to six equivalent Nd atoms to form corner-sharing AlNd6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1197248
title: Materials Data on PRu2 by Materials Project

description: Ru2P is Cotunnite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Ru sites. In the first Ru site, Ru is bonded in a 4-coordinate geometry to four equivalent P atoms. There are a spread of Ru–P bond distances ranging from 2.28–2.44 Å. In the second Ru site, Ru is bonded in a 3-coordinate geometry to five equivalent P atoms. There are a spread of Ru–P bond distances ranging from 2.31–2.91 Å. P is bonded in a 9-coordinate geometry to nine Ru atoms.
DOI: 10.17188/1197249
title: Materials Data on Ce3Co4Sn13 by Materials Project

description: Ce3Co4Sn13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to four equivalent Co and twelve equivalent Sn atoms. All Ce–Co bond lengths are 3.40 Å. There are four shorter (3.34 Å) and eight longer (3.41 Å) Ce–Sn bond lengths. Co is bonded in a 6-coordinate geometry to three equivalent Ce and six equivalent Sn atoms. All Co–Sn bond lengths are 2.61 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 2-coordinate geometry to three equivalent Ce, two equivalent Co, and four Sn atoms. There are a spread of Sn–Sn bond distances ranging from 3.01–3.27 Å. In the second Sn site, Sn is bonded in a cuboctahedral geometry to twelve equivalent Sn atoms.
DOI: 10.17188/1197250
title: Materials Data on Sm(Ni2P)2 by Materials Project

description: SmNi4P2 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. there are two inequivalent Sm2+ sites. In the first Sm2+ site, Sm2+ is bonded in a 6-coordinate geometry to six P3- atoms. There are a spread of Sm–P bond distances ranging from 2.89–2.94 Å. In the second Sm2+ site, Sm2+ is bonded to six P3- atoms to form SmP6 octahedra that share corners with six equivalent NiP4 tetrahedra, edges with two equivalent SmP6 octahedra, and edges with four equivalent NiP4 tetrahedra. There are two shorter (2.86 Å) and four longer (2.91 Å) Sm–P bond lengths. There are six inequivalent Ni1+ sites. In the first Ni1+ site, Ni1+ is bonded in a trigonal non-coplanar geometry to three P3- atoms. There are one shorter (2.18 Å) and two longer (2.27 Å) Ni–P bond lengths. In the second Ni1+ site, Ni1+ is bonded in a bent 120 degrees geometry to two P3- atoms. There are one shorter (2.25 Å) and one longer (2.31 Å) Ni–P bond lengths. In the third Ni1+ site, Ni1+ is bonded in a water-like geometry to two equivalent P3- atoms. Both Ni–P bond lengths are 2.30 Å. In the fourth Ni1+ site, Ni1+ is bonded to four P3- atoms to form NiP4 tetrahedra that share corners with three equivalent SmP6 octahedra, corners with three NiP4 tetrahedra, and edges with two equivalent NiP4 tetrahedra. The corner-sharing octahedra tilt angles range from 42–58°. There are a spread of Ni–P bond distances ranging from 2.22–2.38 Å. In the fifth Ni1+ site, Ni1+ is bonded to four P3- atoms to form NiP4 tetrahedra that share corners with three NiP4 tetrahedra, edges with two equivalent SmP6 octahedra, and edges with two equivalent NiP4 tetrahedra. There are a spread of Ni–P bond distances ranging from 2.30–2.48 Å. In the sixth Ni1+ site, Ni1+ is bonded in a trigonal planar geometry to three P3- atoms. There are two shorter (2.27 Å) and one longer (2.38 Å) Ni–P bond lengths. There are three inequivalent P3- sites. In the first P3- site, P3- is bonded in a 9-coordinate geometry to two equivalent Sm2+ and seven Ni1+ atoms. In the second P3- site, P3- is bonded in a 9-coordinate geometry to three Sm2+ and six Ni1+ atoms. In the third P3- site, P3- is bonded in a 9-coordinate geometry to four Sm2+ and five Ni1+ atoms.