cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1743047
title: Materials Data on FeSb6(Pb2Se7)2 by Materials Project

description: FeSb6(Pb2Se7)2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Fe2+ is bonded to six Se2- atoms to form edge-sharing FeSe6 octahedra. There are a spread of Fe–Se bond distances ranging from 2.49–2.76 Å. There are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 7-coordinate geometry to seven Se2- atoms. There are a spread of Pb–Se bond distances ranging from 2.99–3.71 Å. In the second Pb2+ site, Pb2+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of Pb–Se bond distances ranging from 3.05–3.71 Å. There are three inequivalent Sb3+ sites. In the first Sb3+ site, Sb3+ is bonded to five Se2- atoms to form a mixture of corner and edge-sharing SbSe5 square pyramids. There are a spread of Sb–Se bond distances ranging from 2.64–3.11 Å. In the second Sb3+ site, Sb3+ is bonded in a 5-coordinate geometry to five Se2- atoms. There are a spread of Sb–Se bond distances ranging from 2.65–3.19 Å. In the third Sb3+ site, Sb3+ is bonded to five Se2- atoms to form a mixture of corner and edge-sharing SbSe5 square pyramids. There are a spread of Sb–Se bond distances ranging from 2.62–3.29 Å. There are seven inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a 1-coordinate geometry to four Pb2+ and one Sb3+ atom. In the second Se2- site, Se2- is bonded to one Pb2+ and four Sb3+ atoms to form a mixture of distorted corner and edge-sharing SeSb4Pb square pyramids. In the third Se2- site, Se2- is bonded to one Pb2+ and four Sb3+ atoms to form a mixture of distorted corner and edge-sharing SeSb4Pb square pyramids. In the fourth Se2- site, Se2- is bonded in a 2-coordinate geometry to two Pb2+ and two equivalent Sb3+ atoms. In the fifth Se2- site, Se2- is bonded in a 1-coordinate geometry to four Pb2+ and one Sb3+ atom. In the sixth Se2- site, Se2- is bonded in a 4-coordinate geometry to one Fe2+, one Pb2+, and two equivalent Sb3+ atoms. In the seventh Se2- site, Se2- is bonded in a 5-coordinate geometry to two equivalent Fe2+, two equivalent Pb2+, and one Sb3+ atom.
DOI: 10.17188/1743049
title: Materials Data on NbNi2BO6 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743050
title: Materials Data on MgSi2 by Materials Project

description: MgSi2 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are four inequivalent Mg sites. In the first Mg site, Mg is bonded in a 7-coordinate geometry to seven Si atoms. There are a spread of Mg–Si bond distances ranging from 2.85–2.90 Å. In the second Mg site, Mg is bonded in a 7-coordinate geometry to seven Si atoms. There are a spread of Mg–Si bond distances ranging from 2.85–2.90 Å. In the third Mg site, Mg is bonded in a 7-coordinate geometry to seven Si atoms. There are a spread of Mg–Si bond distances ranging from 2.84–2.90 Å. In the fourth Mg site, Mg is bonded in a 7-coordinate geometry to seven Si atoms. There are a spread of Mg–Si bond distances ranging from 2.84–2.90 Å. There are eight inequivalent Si sites. In the first Si site, Si is bonded to three Mg and three Si atoms to form distorted edge-sharing SiMg3Si3 octahedra. All Si–Si bond lengths are 2.38 Å. In the second Si site, Si is bonded in a 7-coordinate geometry to four Mg and three Si atoms. All Si–Si bond lengths are 2.40 Å. In the third Si site, Si is bonded in a 7-coordinate geometry to four Mg and three Si atoms. All Si–Si bond lengths are 2.40 Å. In the fourth Si site, Si is bonded to three Mg and three Si atoms to form distorted edge-sharing SiMg3Si3 octahedra. All Si–Si bond lengths are 2.38 Å. In the fifth Si site, Si is bonded to three Mg and three Si atoms to form distorted edge-sharing SiMg3Si3 octahedra. In the sixth Si site, Si is bonded in a 7-coordinate geometry to four Mg and three Si atoms. In the seventh Si site, Si is bonded in a 7-coordinate geometry to four Mg and three Si atoms. In the eighth Si site, Si is bonded to three Mg and three Si atoms to form distorted edge-sharing SiMg3Si3 octahedra.
DOI: 10.17188/1743051
title: Materials Data on Mn6O7F5 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743052
title: Materials Data on LiV2(CO3)4 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743054
title: Materials Data on MgSi2 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743055
title: Materials Data on Dy4Ni3Bi8 by Materials Project

description: Dy4Ni3Bi8 crystallizes in the tetragonal P-4m2 space group. The structure is three-dimensional. there are two inequivalent Dy sites. In the first Dy site, Dy is bonded to four equivalent Ni and eight Bi atoms to form a mixture of distorted edge, face, and corner-sharing DyNi4Bi8 cuboctahedra. All Dy–Ni bond lengths are 3.12 Å. There are four shorter (3.30 Å) and four longer (3.41 Å) Dy–Bi bond lengths. In the second Dy site, Dy is bonded in a 11-coordinate geometry to two equivalent Ni and nine Bi atoms. Both Dy–Ni bond lengths are 3.11 Å. There are a spread of Dy–Bi bond distances ranging from 3.32–3.42 Å. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a body-centered cubic geometry to four equivalent Dy and four equivalent Bi atoms. All Ni–Bi bond lengths are 2.66 Å. In the second Ni site, Ni is bonded in a body-centered cubic geometry to four equivalent Dy and four equivalent Bi atoms. All Ni–Bi bond lengths are 2.62 Å. There are four inequivalent Bi sites. In the first Bi site, Bi is bonded in a 7-coordinate geometry to five equivalent Dy and two equivalent Ni atoms. In the second Bi site, Bi is bonded in a 9-coordinate geometry to four equivalent Dy and four equivalent Ni atoms. In the third Bi site, Bi is bonded in a 8-coordinate geometry to four Dy and four equivalent Bi atoms. All Bi–Bi bond lengths are 3.22 Å. In the fourth Bi site, Bi is bonded in a 8-coordinate geometry to four Dy and four equivalent Bi atoms.
DOI: 10.17188/1743056
title: Materials Data on Li4Ni2OF7 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743057
title: Materials Data on Ca3Co2O7 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743058
title: Materials Data on As12S13 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743059
title: Materials Data on SrCaCrF7 by Materials Project

description: SrCaCrF7 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr2+ is bonded in a 8-coordinate geometry to eight F1- atoms. There are a spread of Sr–F bond distances ranging from 2.43–3.05 Å. Ca2+ is bonded to seven F1- atoms to form CaF7 pentagonal bipyramids that share corners with three equivalent CrF6 octahedra, corners with two equivalent CaF7 pentagonal bipyramids, and an edgeedge with one CrF6 octahedra. The corner-sharing octahedra tilt angles range from 33–50°. There are a spread of Ca–F bond distances ranging from 2.29–2.41 Å. Cr3+ is bonded to six F1- atoms to form CrF6 octahedra that share corners with three equivalent CaF7 pentagonal bipyramids and an edgeedge with one CaF7 pentagonal bipyramid. There are a spread of Cr–F bond distances ranging from 1.91–1.96 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to one Sr2+, one Ca2+, and one Cr3+ atom. In the second F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two equivalent Sr2+ and one Cr3+ atom. In the third F1- site, F1- is bonded in a distorted trigonal planar geometry to one Sr2+, one Ca2+, and one Cr3+ atom. In the fourth F1- site, F1- is bonded in a 3-coordinate geometry to one Sr2+, one Ca2+, and one Cr3+ atom. In the fifth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Sr2+ and two equivalent Ca2+ atoms.
DOI: 10.17188/1743060
title: Materials Data on Er2ZnHg by Materials Project

description: Er2HgZn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Er is bonded in a body-centered cubic geometry to four equivalent Hg and four equivalent Zn atoms. All Er–Hg bond lengths are 3.14 Å. All Er–Zn bond lengths are 3.14 Å. Hg is bonded in a body-centered cubic geometry to eight equivalent Er atoms. Zn is bonded in a body-centered cubic geometry to eight equivalent Er atoms.
DOI: 10.17188/1743061
title: Materials Data on Ho2Cu(SiO3)4 by Materials Project

description: Ho2Cu(SiO3)4 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Ho3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Ho–O bond distances ranging from 2.22–2.77 Å. Cu2+ is bonded in a distorted square co-planar geometry to four O2- atoms. There is two shorter (1.98 Å) and two longer (1.99 Å) Cu–O bond length. There are two inequivalent Si4+ sites. In the first Si4+ site, Si4+ is bonded to four O2- atoms to form corner-sharing SiO4 tetrahedra. There are a spread of Si–O bond distances ranging from 1.62–1.67 Å. In the second Si4+ site, Si4+ is bonded to four O2- atoms to form corner-sharing SiO4 tetrahedra. There are a spread of Si–O bond distances ranging from 1.63–1.67 Å. There are six inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to one Ho3+, one Cu2+, and one Si4+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two Si4+ atoms. In the third O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Ho3+ and one Si4+ atom. In the fourth O2- site, O2- is bonded in a 3-coordinate geometry to one Ho3+, one Cu2+, and one Si4+ atom. In the fifth O2- site, O2- is bonded in a bent 150 degrees geometry to one Ho3+ and two Si4+ atoms. In the sixth O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Ho3+ and one Si4+ atom.
DOI: 10.17188/1743062
title: Materials Data on CeSe2 by Materials Project

description: CeSe2 is quartz (beta)-like structured and crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are three inequivalent Ce4+ sites. In the first Ce4+ site, Ce4+ is bonded to four Se2- atoms to form corner-sharing CeSe4 tetrahedra. There are three shorter (2.71 Å) and one longer (2.72 Å) Ce–Se bond lengths. In the second Ce4+ site, Ce4+ is bonded to four Se2- atoms to form corner-sharing CeSe4 tetrahedra. There are two shorter (2.71 Å) and two longer (2.72 Å) Ce–Se bond lengths. In the third Ce4+ site, Ce4+ is bonded to four Se2- atoms to form corner-sharing CeSe4 tetrahedra. There are one shorter (2.71 Å) and three longer (2.72 Å) Ce–Se bond lengths. There are eight inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a bent 150 degrees geometry to two Ce4+ atoms. In the second Se2- site, Se2- is bonded in a bent 150 degrees geometry to two equivalent Ce4+ atoms. In the third Se2- site, Se2- is bonded in a bent 150 degrees geometry to two Ce4+ atoms. In the fourth Se2- site, Se2- is bonded in a bent 150 degrees geometry to two Ce4+ atoms. In the fifth Se2- site, Se2- is bonded in a bent 150 degrees geometry to two equivalent Ce4+ atoms. In the sixth Se2- site, Se2- is bonded in a bent 150 degrees geometry to two equivalent Ce4+ atoms. In the seventh Se2- site, Se2- is bonded in a bent 150 degrees geometry to two equivalent Ce4+ atoms. In the eighth Se2- site, Se2- is bonded in a bent 150 degrees geometry to two Ce4+ atoms.
DOI: 10.17188/1743063
title: Materials Data on Na14Mn2O9 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743064
title: Materials Data on CeCuN2 by Materials Project

description: CeCuN2 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. Ce4+ is bonded in a body-centered cubic geometry to eight equivalent N3- atoms. All Ce–N bond lengths are 2.55 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent N3- atoms. All Cu–N bond lengths are 1.96 Å. N3- is bonded to four equivalent Ce4+ and two equivalent Cu2+ atoms to form a mixture of face, edge, and corner-sharing NCe4Cu2 octahedra. The corner-sharing octahedra tilt angles range from 0–66°.
DOI: 10.17188/1743065
title: Materials Data on ZrCoN2 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743066
title: Materials Data on CoIr by Materials Project

description: IrCo crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Ir is bonded to six equivalent Ir and six equivalent Co atoms to form distorted IrCo6Ir6 cuboctahedra that share corners with eighteen equivalent IrCo6Ir6 cuboctahedra, edges with six equivalent IrCo6Ir6 cuboctahedra, edges with twelve equivalent CoCo6Ir6 cuboctahedra, faces with eight equivalent IrCo6Ir6 cuboctahedra, and faces with twelve equivalent CoCo6Ir6 cuboctahedra. All Ir–Ir bond lengths are 2.67 Å. All Ir–Co bond lengths are 2.57 Å. Co is bonded to six equivalent Ir and six equivalent Co atoms to form distorted CoCo6Ir6 cuboctahedra that share corners with eighteen equivalent CoCo6Ir6 cuboctahedra, edges with six equivalent CoCo6Ir6 cuboctahedra, edges with twelve equivalent IrCo6Ir6 cuboctahedra, faces with eight equivalent CoCo6Ir6 cuboctahedra, and faces with twelve equivalent IrCo6Ir6 cuboctahedra. All Co–Co bond lengths are 2.67 Å.
DOI: 10.17188/1743067
title: Materials Data on SrV2(NiO4)2 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743068
title: Materials Data on U(AlFe)6 by Materials Project

description: UFe6Al6 crystallizes in the orthorhombic Immm space group. The structure is three-dimensional. U is bonded in a 12-coordinate geometry to twelve Fe and eight Al atoms. There are four shorter (3.16 Å) and eight longer (3.28 Å) U–Fe bond lengths. There are a spread of U–Al bond distances ranging from 2.91–3.02 Å. There are two inequivalent Fe sites. In the first Fe site, Fe is bonded in a 12-coordinate geometry to two equivalent U, four Fe, and six Al atoms. There are two shorter (2.47 Å) and two longer (2.50 Å) Fe–Fe bond lengths. There are two shorter (2.50 Å) and four longer (2.61 Å) Fe–Al bond lengths. In the second Fe site, Fe is bonded to two equivalent U, four equivalent Fe, and six Al atoms to form a mixture of distorted corner, edge, and face-sharing FeU2Al6Fe4 cuboctahedra. There are two shorter (2.62 Å) and four longer (2.64 Å) Fe–Al bond lengths. There are three inequivalent Al sites. In the first Al site, Al is bonded in a 10-coordinate geometry to one U, six Fe, and three Al atoms. There are one shorter (2.62 Å) and two longer (2.79 Å) Al–Al bond lengths. In the second Al site, Al is bonded in a 8-coordinate geometry to one U, six Fe, and three Al atoms. There are one shorter (2.69 Å) and two longer (2.93 Å) Al–Al bond lengths. In the third Al site, Al is bonded in a 12-coordinate geometry to two equivalent U, six Fe, and four Al atoms.
DOI: 10.17188/1743070
title: Materials Data on La2(N4O9)3 by Materials Project

description: (La2(NO3)9)2(N2)3 crystallizes in the cubic P4_132 space group. The structure is three-dimensional and consists of twelve ammonia molecules and one La2(NO3)9 framework. In the La2(NO3)9 framework, La3+ is bonded to twelve O2- atoms to form distorted corner-sharing LaO12 cuboctahedra. There are a spread of La–O bond distances ranging from 2.63–2.75 Å. There are two inequivalent N4+ sites. In the first N4+ site, N4+ is bonded in a trigonal planar geometry to three O2- atoms. There is one shorter (1.25 Å) and two longer (1.27 Å) N–O bond length. In the second N4+ site, N4+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.25 Å) and one longer (1.31 Å) N–O bond length. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one La3+ and one N4+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one La3+ and one N4+ atom. In the third O2- site, O2- is bonded in a single-bond geometry to one N4+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent La3+ and one N4+ atom. In the fifth O2- site, O2- is bonded in a distorted single-bond geometry to one La3+ and one N4+ atom.
DOI: 10.17188/1743072
title: Materials Data on K3(SeO4)2 by Materials Project

description: K3(SeO4)2 crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of one K3(SeO4)2 sheet oriented in the (0, 0, 1) direction. there are two inequivalent K sites. In the first K site, K is bonded in a distorted single-bond geometry to one O atom. The K–O bond length is 2.58 Å. In the second K site, K is bonded to six equivalent O atoms to form KO6 octahedra that share corners with six equivalent SeO4 tetrahedra. All K–O bond lengths are 2.64 Å. Se is bonded to four O atoms to form SeO4 tetrahedra that share corners with three equivalent KO6 octahedra. The corner-sharing octahedral tilt angles are 10°. There is one shorter (1.66 Å) and three longer (1.68 Å) Se–O bond length. There are two inequivalent O sites. In the first O site, O is bonded in a 2-coordinate geometry to one K and one Se atom. In the second O site, O is bonded in a linear geometry to one K and one Se atom.
DOI: 10.17188/1743073
title: Materials Data on MnB2(H7N)2 by Materials Project

description: MnB2(NH7)2 crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight MnB2(NH7)2 clusters. Mn2+ is bonded in a 7-coordinate geometry to two N3- and five H+0.71+ atoms. There are one shorter (2.19 Å) and one longer (2.21 Å) Mn–N bond lengths. There are a spread of Mn–H bond distances ranging from 1.92–2.32 Å. There are two inequivalent B3- sites. In the first B3- site, B3- is bonded in a tetrahedral geometry to four H+0.71+ atoms. There are a spread of B–H bond distances ranging from 1.21–1.25 Å. In the second B3- site, B3- is bonded in a tetrahedral geometry to four H+0.71+ atoms. There is two shorter (1.22 Å) and two longer (1.25 Å) B–H bond length. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a distorted trigonal non-coplanar geometry to one Mn2+ and three H+0.71+ atoms. There is one shorter (1.02 Å) and two longer (1.03 Å) N–H bond length. In the second N3- site, N3- is bonded in a distorted trigonal non-coplanar geometry to one Mn2+ and three H+0.71+ atoms. All N–H bond lengths are 1.03 Å. There are fourteen inequivalent H+0.71+ sites. In the first H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one N3- atom. In the second H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one N3- atom. In the third H+0.71+ site, H+0.71+ is bonded in a distorted L-shaped geometry to one Mn2+ and one B3- atom. In the fourth H+0.71+ site, H+0.71+ is bonded in an L-shaped geometry to one Mn2+ and one B3- atom. In the fifth H+0.71+ site, H+0.71+ is bonded in a distorted L-shaped geometry to one Mn2+ and one B3- atom. In the sixth H+0.71+ site, H+0.71+ is bonded in a distorted single-bond geometry to one Mn2+ and one B3- atom. In the seventh H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one N3- atom. In the eighth H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one N3- atom. In the ninth H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one B3- atom. In the tenth H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one B3- atom. In the eleventh H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one Mn2+ and one B3- atom. In the twelfth H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one N3- atom. In the thirteenth H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one N3- atom. In the fourteenth H+0.71+ site, H+0.71+ is bonded in a single-bond geometry to one B3- atom.
DOI: 10.17188/1743074
title: Materials Data on Cs2VBr5O4 by Materials Project

description: (Cs)2VO4(Br)5 crystallizes in the monoclinic C2/m space group. The structure is zero-dimensional and consists of four cesium molecules, ten hydrobromic acid molecules, and two orthovanadate molecules.
DOI: 10.17188/1743075
title: Materials Data on CaVN2 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743076
title: Materials Data on Rb2Mn(PO3)4 by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1743077
title: Materials Data on TbGePd by Materials Project

description: TbPdGe crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Ge atoms. There are a spread of Tb–Pd bond distances ranging from 3.06–3.20 Å. There are a spread of Tb–Ge bond distances ranging from 3.08–3.24 Å. Pd is bonded in a 10-coordinate geometry to six equivalent Tb, one Pd, and three equivalent Ge atoms. The Pd–Pd bond length is 2.86 Å. There are two shorter (2.53 Å) and one longer (2.82 Å) Pd–Ge bond lengths. Ge is bonded in a 10-coordinate geometry to six equivalent Tb, three equivalent Pd, and one Ge atom. The Ge–Ge bond length is 2.58 Å.