cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1314770
title: Materials Data on RbF3 by Materials Project

description: RbF3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Rb is bonded to twelve F atoms to form a mixture of edge, face, and corner-sharing RbF12 cuboctahedra. There are four shorter (2.88 Å) and eight longer (2.98 Å) Rb–F bond lengths. There are two inequivalent F sites. In the first F site, F is bonded in a 4-coordinate geometry to four equivalent Rb atoms. In the second F site, F is bonded in a square co-planar geometry to four equivalent Rb atoms.
DOI: 10.17188/1314771
title: Materials Data on La3Mg by Materials Project

description: MgLa3 is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Mg is bonded to twelve equivalent La atoms to form MgLa12 cuboctahedra that share corners with six equivalent MgLa12 cuboctahedra, corners with twelve equivalent LaLa8Mg4 cuboctahedra, edges with eighteen equivalent LaLa8Mg4 cuboctahedra, faces with eight equivalent MgLa12 cuboctahedra, and faces with twelve equivalent LaLa8Mg4 cuboctahedra. There are six shorter (3.51 Å) and six longer (3.67 Å) Mg–La bond lengths. La is bonded to four equivalent Mg and eight equivalent La atoms to form distorted LaLa8Mg4 cuboctahedra that share corners with four equivalent MgLa12 cuboctahedra, corners with fourteen equivalent LaLa8Mg4 cuboctahedra, edges with six equivalent MgLa12 cuboctahedra, edges with twelve equivalent LaLa8Mg4 cuboctahedra, faces with four equivalent MgLa12 cuboctahedra, and faces with sixteen equivalent LaLa8Mg4 cuboctahedra. There are a spread of La–La bond distances ranging from 3.47–3.86 Å.
DOI: 10.17188/1314772
title: Materials Data on RbMnO3 by Materials Project

description: RbMnO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent MnO6 octahedra. All Rb–O bond lengths are 2.86 Å. Mn is bonded to six equivalent O atoms to form MnO6 octahedra that share corners with six equivalent MnO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Mn–O bond lengths are 2.02 Å. O is bonded in a distorted linear geometry to four equivalent Rb and two equivalent Mn atoms.
DOI: 10.17188/1314773
title: Materials Data on NdGeO3 by Materials Project

description: NdGeO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Nd2+ is bonded to twelve equivalent O2- atoms to form NdO12 cuboctahedra that share corners with twelve equivalent NdO12 cuboctahedra, faces with six equivalent NdO12 cuboctahedra, and faces with eight equivalent GeO6 octahedra. All Nd–O bond lengths are 2.81 Å. Ge4+ is bonded to six equivalent O2- atoms to form GeO6 octahedra that share corners with six equivalent GeO6 octahedra and faces with eight equivalent NdO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ge–O bond lengths are 1.98 Å. O2- is bonded in a distorted linear geometry to four equivalent Nd2+ and two equivalent Ge4+ atoms.
DOI: 10.17188/1314774
title: Materials Data on Rb(FeAs)2 by Materials Project

description: RbFe2As2 is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Rb1+ is bonded in a body-centered cubic geometry to eight equivalent As3- atoms. All Rb–As bond lengths are 3.46 Å. Fe+2.50+ is bonded to four equivalent As3- atoms to form a mixture of edge and corner-sharing FeAs4 tetrahedra. All Fe–As bond lengths are 2.34 Å. As3- is bonded in a 8-coordinate geometry to four equivalent Rb1+ and four equivalent Fe+2.50+ atoms.
DOI: 10.17188/1314775
title: Materials Data on RbErO3 by Materials Project

description: RbErO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent ErO6 octahedra. All Rb–O bond lengths are 3.18 Å. Er is bonded to six equivalent O atoms to form ErO6 octahedra that share corners with six equivalent ErO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Er–O bond lengths are 2.25 Å. O is bonded in a distorted linear geometry to four equivalent Rb and two equivalent Er atoms.
DOI: 10.17188/1314776
title: Materials Data on RbCuO3 by Materials Project

description: RbCuO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent CuO6 octahedra. All Rb–O bond lengths are 2.86 Å. Cu is bonded to six equivalent O atoms to form CuO6 octahedra that share corners with six equivalent CuO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–O bond lengths are 2.02 Å. O is bonded to four equivalent Rb and two equivalent Cu atoms to form a mixture of distorted face, edge, and corner-sharing ORb4Cu2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1314777
title: Materials Data on LiCa2Mg by Materials Project

description: LiCa2Mg is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Ca atoms. All Li–Ca bond lengths are 3.44 Å. Ca is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Mg atoms. All Ca–Mg bond lengths are 3.44 Å. Mg is bonded in a body-centered cubic geometry to eight equivalent Ca atoms.
DOI: 10.17188/1314778
title: Materials Data on RbNiO3 by Materials Project

description: RbNiO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent NiO6 octahedra. All Rb–O bond lengths are 2.87 Å. Ni is bonded to six equivalent O atoms to form NiO6 octahedra that share corners with six equivalent NiO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ni–O bond lengths are 2.03 Å. O is bonded to four equivalent Rb and two equivalent Ni atoms to form a mixture of distorted edge, corner, and face-sharing ORb4Ni2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1314779
title: Materials Data on RbCdO3 by Materials Project

description: RbCdO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent CdO6 octahedra. All Rb–O bond lengths are 3.16 Å. Cd is bonded to six equivalent O atoms to form CdO6 octahedra that share corners with six equivalent CdO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cd–O bond lengths are 2.23 Å. O is bonded to four equivalent Rb and two equivalent Cd atoms to form a mixture of distorted face, edge, and corner-sharing ORb4Cd2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1314780
title: Materials Data on RbCaO3 by Materials Project

description: RbCaO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent CaO6 octahedra. All Rb–O bond lengths are 3.26 Å. Ca is bonded to six equivalent O atoms to form CaO6 octahedra that share corners with six equivalent CaO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ca–O bond lengths are 2.31 Å. O is bonded in a distorted linear geometry to four equivalent Rb and two equivalent Ca atoms.
DOI: 10.17188/1314781
title: Materials Data on RbCa3 by Materials Project

description: RbCa3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent Ca atoms to form RbCa12 cuboctahedra that share corners with twelve equivalent RbCa12 cuboctahedra, edges with twenty-four equivalent CaRb4Ca8 cuboctahedra, faces with six equivalent RbCa12 cuboctahedra, and faces with twelve equivalent CaRb4Ca8 cuboctahedra. All Rb–Ca bond lengths are 4.12 Å. Ca is bonded to four equivalent Rb and eight equivalent Ca atoms to form CaRb4Ca8 cuboctahedra that share corners with twelve equivalent CaRb4Ca8 cuboctahedra, edges with eight equivalent RbCa12 cuboctahedra, edges with sixteen equivalent CaRb4Ca8 cuboctahedra, faces with four equivalent RbCa12 cuboctahedra, and faces with fourteen equivalent CaRb4Ca8 cuboctahedra. All Ca–Ca bond lengths are 4.12 Å.
DOI: 10.17188/1314782
title: Materials Data on RbBiO3 by Materials Project

description: RbBiO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb1+ is bonded to twelve equivalent O2- atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent BiO6 octahedra. All Rb–O bond lengths are 3.07 Å. Bi5+ is bonded to six equivalent O2- atoms to form BiO6 octahedra that share corners with six equivalent BiO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Bi–O bond lengths are 2.17 Å. O2- is bonded to four equivalent Rb1+ and two equivalent Bi5+ atoms to form a mixture of distorted edge, face, and corner-sharing ORb4Bi2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1314783
title: Materials Data on RbBO3 by Materials Project

description: RbBO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent BO6 octahedra. All Rb–O bond lengths are 2.61 Å. B is bonded to six equivalent O atoms to form BO6 octahedra that share corners with six equivalent BO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All B–O bond lengths are 1.85 Å. O is bonded to four equivalent Rb and two equivalent B atoms to form a mixture of distorted edge, face, and corner-sharing ORb4B2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1314784
title: Materials Data on RbDyO3 by Materials Project

description: RbDyO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent DyO6 octahedra. All Rb–O bond lengths are 3.20 Å. Dy is bonded to six equivalent O atoms to form DyO6 octahedra that share corners with six equivalent DyO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Dy–O bond lengths are 2.26 Å. O is bonded in a distorted linear geometry to four equivalent Rb and two equivalent Dy atoms.
DOI: 10.17188/1314785
title: Materials Data on RbBaO3 by Materials Project

description: RbBaO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent BaO6 octahedra. All Rb–O bond lengths are 3.53 Å. Ba is bonded to six equivalent O atoms to form BaO6 octahedra that share corners with six equivalent BaO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ba–O bond lengths are 2.50 Å. O is bonded in a linear geometry to four equivalent Rb and two equivalent Ba atoms.
DOI: 10.17188/1314786
title: Materials Data on NdDy3 by Materials Project

description: Dy3Nd is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Dy is bonded to eight equivalent Dy and four equivalent Nd atoms to form DyNd4Dy8 cuboctahedra that share corners with twelve equivalent DyNd4Dy8 cuboctahedra, edges with eight equivalent NdDy12 cuboctahedra, edges with sixteen equivalent DyNd4Dy8 cuboctahedra, faces with four equivalent NdDy12 cuboctahedra, and faces with fourteen equivalent DyNd4Dy8 cuboctahedra. All Dy–Dy bond lengths are 3.58 Å. All Dy–Nd bond lengths are 3.58 Å. Nd is bonded to twelve equivalent Dy atoms to form NdDy12 cuboctahedra that share corners with twelve equivalent NdDy12 cuboctahedra, edges with twenty-four equivalent DyNd4Dy8 cuboctahedra, faces with six equivalent NdDy12 cuboctahedra, and faces with twelve equivalent DyNd4Dy8 cuboctahedra.
DOI: 10.17188/1314787
title: Materials Data on RbCa3 by Materials Project

description: RbCa3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Rb is bonded in a body-centered cubic geometry to fourteen Ca atoms. There are eight shorter (4.01 Å) and six longer (4.63 Å) Rb–Ca bond lengths. There are two inequivalent Ca sites. In the first Ca site, Ca is bonded in a body-centered cubic geometry to four equivalent Rb and four equivalent Ca atoms. All Ca–Ca bond lengths are 4.01 Å. In the second Ca site, Ca is bonded in a distorted body-centered cubic geometry to six equivalent Rb and eight equivalent Ca atoms.
DOI: 10.17188/1314788
title: Materials Data on RbBeO3 by Materials Project

description: RbBeO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent BeO6 octahedra. All Rb–O bond lengths are 2.74 Å. Be is bonded to six equivalent O atoms to form BeO6 octahedra that share corners with six equivalent BeO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Be–O bond lengths are 1.94 Å. O is bonded in a distorted linear geometry to four equivalent Rb and two equivalent Be atoms.
DOI: 10.17188/1314789
title: Materials Data on Nd(Mg4Al3)4 by Materials Project

description: Nd(Mg4Al3)4 crystallizes in the cubic I-43m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 10-coordinate geometry to three equivalent Mg, one Nd, and six equivalent Al atoms. All Mg–Mg bond lengths are 3.02 Å. The Mg–Nd bond length is 3.31 Å. All Mg–Al bond lengths are 3.20 Å. In the second Mg site, Mg is bonded in a 12-coordinate geometry to seven Mg and five equivalent Al atoms. There are two shorter (3.10 Å) and four longer (3.17 Å) Mg–Mg bond lengths. There are a spread of Mg–Al bond distances ranging from 2.84–3.17 Å. Nd is bonded in a 12-coordinate geometry to four equivalent Mg and twelve equivalent Al atoms. All Nd–Al bond lengths are 3.25 Å. Al is bonded in a 11-coordinate geometry to seven Mg, one Nd, and three equivalent Al atoms. There are one shorter (2.73 Å) and two longer (2.80 Å) Al–Al bond lengths.
DOI: 10.17188/1314790
title: Materials Data on RbBa3 by Materials Project

description: RbBa3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Rb is bonded in a body-centered cubic geometry to eight equivalent Ba atoms. All Rb–Ba bond lengths are 4.49 Å. There are two inequivalent Ba sites. In the first Ba site, Ba is bonded in a body-centered cubic geometry to four equivalent Rb and four equivalent Ba atoms. All Ba–Ba bond lengths are 4.49 Å. In the second Ba site, Ba is bonded in a body-centered cubic geometry to eight equivalent Ba atoms.
DOI: 10.17188/1314791
title: Materials Data on RbCa3 by Materials Project

description: RbCa3 is beta Cu3Ti-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Rb is bonded to twelve Ca atoms to form RbCa12 cuboctahedra that share corners with four equivalent RbCa12 cuboctahedra, corners with eight equivalent CaRb4Ca8 cuboctahedra, edges with eight equivalent RbCa12 cuboctahedra, edges with sixteen equivalent CaRb4Ca8 cuboctahedra, faces with four equivalent RbCa12 cuboctahedra, and faces with fourteen CaRb4Ca8 cuboctahedra. There are four shorter (4.12 Å) and eight longer (4.13 Å) Rb–Ca bond lengths. There are two inequivalent Ca sites. In the first Ca site, Ca is bonded to four equivalent Rb and eight Ca atoms to form CaRb4Ca8 cuboctahedra that share corners with twelve equivalent CaRb4Ca8 cuboctahedra, edges with eight equivalent RbCa12 cuboctahedra, edges with sixteen CaRb4Ca8 cuboctahedra, faces with four equivalent RbCa12 cuboctahedra, and faces with fourteen CaRb4Ca8 cuboctahedra. There are four shorter (4.12 Å) and four longer (4.13 Å) Ca–Ca bond lengths. In the second Ca site, Ca is bonded to four equivalent Rb and eight equivalent Ca atoms to form CaRb4Ca8 cuboctahedra that share corners with four equivalent CaRb4Ca8 cuboctahedra, corners with eight equivalent RbCa12 cuboctahedra, edges with twenty-four CaRb4Ca8 cuboctahedra, faces with six equivalent RbCa12 cuboctahedra, and faces with twelve CaRb4Ca8 cuboctahedra.
DOI: 10.17188/1314792
title: Materials Data on RbAuO3 by Materials Project

description: RbAuO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb1+ is bonded to twelve equivalent O2- atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent AuO6 octahedra. All Rb–O bond lengths are 2.98 Å. Au5+ is bonded to six equivalent O2- atoms to form AuO6 octahedra that share corners with six equivalent AuO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Au–O bond lengths are 2.11 Å. O2- is bonded to four equivalent Rb1+ and two equivalent Au5+ atoms to form a mixture of distorted corner, edge, and face-sharing ORb4Au2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1314793
title: Materials Data on RbAgO3 by Materials Project

description: RbAgO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent AgO6 octahedra. All Rb–O bond lengths are 3.01 Å. Ag is bonded to six equivalent O atoms to form AgO6 octahedra that share corners with six equivalent AgO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Ag–O bond lengths are 2.13 Å. O is bonded to four equivalent Rb and two equivalent Ag atoms to form a mixture of distorted edge, corner, and face-sharing ORb4Ag2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1314794
title: Materials Data on RbF3 by Materials Project

description: RbF3 crystallizes in the monoclinic Pm space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a 12-coordinate geometry to twelve F atoms. There are a spread of Rb–F bond distances ranging from 2.89–3.28 Å. In the second Rb site, Rb is bonded to twelve F atoms to form a mixture of distorted corner and face-sharing RbF12 cuboctahedra. There are a spread of Rb–F bond distances ranging from 2.89–3.29 Å. There are six inequivalent F sites. In the first F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the second F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the third F site, F is bonded in a 2-coordinate geometry to four Rb atoms. In the fourth F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the fifth F site, F is bonded in a distorted see-saw-like geometry to four Rb atoms. In the sixth F site, F is bonded in a 2-coordinate geometry to four Rb atoms.
DOI: 10.5517/ccrqckc
title: CCDC 706693: Experimental Crystal Structure Determination

description: Related Article: Yan-ping You, Qian Wang, Miao Du|2007|Tianjin Shif.Dax.Xue.Zir.Kex.|27|1-3|
DOI: 10.5517/cc12xf4k
title: CCDC 1010418: Experimental Crystal Structure Determination

description: Related Article: Yongfen Wang, Chuanzhou Bian|2014|CSD Communication|||
DOI: 10.17188/1314795
title: Materials Data on MnNiP by Materials Project

description: MnNiP crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Mn2+ is bonded to five P3- atoms to form distorted MnP5 trigonal bipyramids that share corners with six equivalent NiP4 tetrahedra, corners with ten equivalent MnP5 trigonal bipyramids, edges with six equivalent NiP4 tetrahedra, and edges with six equivalent MnP5 trigonal bipyramids. There are one shorter (2.34 Å) and four longer (2.49 Å) Mn–P bond lengths. Ni1+ is bonded to four P3- atoms to form NiP4 tetrahedra that share corners with ten equivalent NiP4 tetrahedra, corners with six equivalent MnP5 trigonal bipyramids, edges with two equivalent NiP4 tetrahedra, and edges with six equivalent MnP5 trigonal bipyramids. There are two shorter (2.21 Å) and two longer (2.30 Å) Ni–P bond lengths. There are two inequivalent P3- sites. In the first P3- site, P3- is bonded in a 9-coordinate geometry to three equivalent Mn2+ and six equivalent Ni1+ atoms. In the second P3- site, P3- is bonded in a 9-coordinate geometry to six equivalent Mn2+ and three equivalent Ni1+ atoms.