cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1664972
title: Materials Data on LiY9(Si3O13)2 by Materials Project

description: LiY9(SiO4)6O2 crystallizes in the trigonal P3 space group. The structure is three-dimensional. Li1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are three shorter (2.26 Å) and three longer (2.59 Å) Li–O bond lengths. There are five inequivalent Y3+ sites. In the first Y3+ site, Y3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Y–O bond distances ranging from 2.23–2.71 Å. In the second Y3+ site, Y3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Y–O bond distances ranging from 2.21–2.86 Å. In the third Y3+ site, Y3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Y–O bond distances ranging from 2.31–2.76 Å. In the fourth Y3+ site, Y3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Y–O bond distances ranging from 2.31–2.77 Å. In the fifth Y3+ site, Y3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Y–O bond distances ranging from 2.33–2.81 Å. There are two inequivalent Si4+ sites. In the first Si4+ site, Si4+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of Si–O bond distances ranging from 1.61–1.66 Å. In the second Si4+ site, Si4+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of Si–O bond distances ranging from 1.63–1.65 Å. There are ten inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to three Y3+ and one Si4+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to one Li1+, two Y3+, and one Si4+ atom. In the third O2- site, O2- is bonded in a trigonal planar geometry to three equivalent Y3+ atoms. In the fourth O2- site, O2- is bonded in a trigonal planar geometry to three equivalent Y3+ atoms. In the fifth O2- site, O2- is bonded in a 1-coordinate geometry to three Y3+ and one Si4+ atom. In the sixth O2- site, O2- is bonded in a 3-coordinate geometry to two Y3+ and one Si4+ atom. In the seventh O2- site, O2- is bonded in a 1-coordinate geometry to three Y3+ and one Si4+ atom. In the eighth O2- site, O2- is bonded in a 1-coordinate geometry to three Y3+ and one Si4+ atom. In the ninth O2- site, O2- is bonded in a 1-coordinate geometry to one Li1+, two Y3+, and one Si4+ atom. In the tenth O2- site, O2- is bonded in a 1-coordinate geometry to three Y3+ and one Si4+ atom.
DOI: 10.17188/1664973
title: Materials Data on Mn3VO8 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: 10.17188/1664974
title: Materials Data on Na3FeBPO7 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: 10.6084/m9.figshare.13670746
title: Ribosomal protein database of Hafnia alvei FB1

description: This work presents the ribosomal protein database of <i>Hafnia alvei </i>FB1<i>. </i>Original data for the work came from the annotated proteome data of the bacterium downloaded from UniProt. Using an in-house MATLAB ribosomal protein database analysis software, the original proteome data file was parsed to extract protein name and amino acid sequence of all ribosomal proteins in the species. The database also includes calculated variables such as number of residues, molecular weight, and nucleotide sequence. Overall, the presented database could serve as a ribosomal protein mass fingerprint for use in microbial identification, or it could be used in fundamental studies seeking to uncover new insights into ribosomal protein biology.
DOI: 10.6084/m9.figshare.13670746.v1
title: Ribosomal protein database of Hafnia alvei FB1

description: This work presents the ribosomal protein database of <i>Hafnia alvei </i>FB1<i>. </i>Original data for the work came from the annotated proteome data of the bacterium downloaded from UniProt. Using an in-house MATLAB ribosomal protein database analysis software, the original proteome data file was parsed to extract protein name and amino acid sequence of all ribosomal proteins in the species. The database also includes calculated variables such as number of residues, molecular weight, and nucleotide sequence. Overall, the presented database could serve as a ribosomal protein mass fingerprint for use in microbial identification, or it could be used in fundamental studies seeking to uncover new insights into ribosomal protein biology.
DOI: 10.17188/1664975
title: Materials Data on SrCaI4 by Materials Project

description: SrCaI4 is beta Vanadium nitride-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Sr2+ is bonded to six I1- atoms to form SrI6 octahedra that share corners with eight equivalent CaI6 octahedra and edges with two equivalent SrI6 octahedra. The corner-sharing octahedra tilt angles range from 47–49°. There are four shorter (3.28 Å) and two longer (3.32 Å) Sr–I bond lengths. Ca2+ is bonded to six I1- atoms to form CaI6 octahedra that share corners with eight equivalent SrI6 octahedra and edges with two equivalent CaI6 octahedra. The corner-sharing octahedra tilt angles range from 47–49°. There are two shorter (3.16 Å) and four longer (3.17 Å) Ca–I bond lengths. There are two inequivalent I1- sites. In the first I1- site, I1- is bonded in a distorted T-shaped geometry to two equivalent Sr2+ and one Ca2+ atom. In the second I1- site, I1- is bonded in a distorted trigonal planar geometry to one Sr2+ and two equivalent Ca2+ atoms.
DOI: 10.17188/1664976
title: Materials Data on Li3Mn3NiO8 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: 10.17188/1664977
title: Materials Data on Ce2Zn5Sn by Materials Project

description: Ce2Zn5Sn crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Ce sites. In the first Ce site, Ce is bonded in a 11-coordinate geometry to thirteen Zn and two equivalent Sn atoms. There are a spread of Ce–Zn bond distances ranging from 3.08–3.26 Å. Both Ce–Sn bond lengths are 3.33 Å. In the second Ce site, Ce is bonded in a 6-coordinate geometry to ten Zn and four equivalent Sn atoms. There are a spread of Ce–Zn bond distances ranging from 3.20–3.59 Å. All Ce–Sn bond lengths are 3.28 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a 10-coordinate geometry to four Ce and six Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.52–2.89 Å. In the second Zn site, Zn is bonded in a 1-coordinate geometry to five Ce, four Zn, and one Sn atom. The Zn–Zn bond length is 2.53 Å. The Zn–Sn bond length is 2.66 Å. In the third Zn site, Zn is bonded in a 1-coordinate geometry to five Ce, six Zn, and one Sn atom. The Zn–Sn bond length is 2.66 Å. Sn is bonded in a 9-coordinate geometry to six Ce and three Zn atoms.
DOI: 10.17188/1664978
title: Materials Data on Th2I2N by Materials Project

description: Th2NI2 is Cyanogen Chloride-like structured and crystallizes in the tetragonal P4/mmm space group. The structure is zero-dimensional and consists of one Th2NI2 cluster. Th is bonded in a distorted linear geometry to one N and one I atom. The Th–N bond length is 2.07 Å. The Th–I bond length is 2.97 Å. N is bonded in a linear geometry to two equivalent Th atoms. I is bonded in a single-bond geometry to one Th atom.
DOI: 10.17188/1664979
title: Materials Data on Ba4Na(FeAs)10 by Materials Project

description: NaBa4(FeAs)10 is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. Na1+ is bonded in a body-centered cubic geometry to eight equivalent As3- atoms. All Na–As bond lengths are 3.37 Å. Ba2+ is bonded in a body-centered cubic geometry to eight As3- atoms. There are a spread of Ba–As bond distances ranging from 3.36–3.43 Å. There are two inequivalent Fe+2.10+ sites. In the first Fe+2.10+ site, Fe+2.10+ is bonded to four As3- atoms to form a mixture of edge and corner-sharing FeAs4 tetrahedra. There are three shorter (2.32 Å) and one longer (2.33 Å) Fe–As bond lengths. In the second Fe+2.10+ site, Fe+2.10+ is bonded to four equivalent As3- atoms to form a mixture of edge and corner-sharing FeAs4 tetrahedra. All Fe–As bond lengths are 2.33 Å. There are two inequivalent As3- sites. In the first As3- site, As3- is bonded in a 8-coordinate geometry to one Na1+, three equivalent Ba2+, and four Fe+2.10+ atoms. In the second As3- site, As3- is bonded in a 8-coordinate geometry to four equivalent Ba2+ and four equivalent Fe+2.10+ atoms.
DOI: 10.17188/1664980
title: Materials Data on Sr2GdBiO6 by Materials Project

description: Sr2GdBiO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic P2_1/c 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 2.54–3.08 Å. Gd3+ is bonded to six O2- atoms to form GdO6 octahedra that share corners with six equivalent BiO6 octahedra. The corner-sharing octahedra tilt angles range from 30–33°. There are two shorter (2.28 Å) and four longer (2.30 Å) Gd–O bond lengths. Bi5+ is bonded to six O2- atoms to form BiO6 octahedra that share corners with six equivalent GdO6 octahedra. The corner-sharing octahedra tilt angles range from 30–33°. There are two shorter (2.15 Å) and four longer (2.16 Å) Bi–O bond lengths. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded to two equivalent Sr2+, one Gd3+, and one Bi5+ atom to form distorted corner-sharing OSr2GdBi tetrahedra. In the second O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one Gd3+, and one Bi5+ atom. In the third O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Sr2+, one Gd3+, and one Bi5+ atom.
DOI: 10.17188/1664981
title: Materials Data on K2MoCl5O 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: 10.17188/1664982
title: Materials Data on Rb2Ni(SO7)2 by Materials Project

description: Rb2Ni(SO7)2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Rb is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of Rb–O bond distances ranging from 2.89–3.38 Å. Ni is bonded in a distorted octahedral geometry to six O atoms. There is four shorter (1.82 Å) and two longer (1.83 Å) Ni–O bond length. S is bonded in a tetrahedral geometry to four O atoms. There are a spread of S–O bond distances ranging from 1.46–1.52 Å. There are seven inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to two equivalent Rb and one S atom. In the second O site, O is bonded in a distorted single-bond geometry to one Rb and one S atom. In the third O site, O is bonded in a single-bond geometry to two equivalent Rb and one S atom. In the fourth O site, O is bonded in a single-bond geometry to one Rb and one Ni atom. In the fifth O site, O is bonded in a distorted single-bond geometry to one Rb and one S atom. In the sixth O site, O is bonded in a distorted single-bond geometry to one Rb and one Ni atom. In the seventh O site, O is bonded in a single-bond geometry to one Ni atom.
DOI: 10.17188/1664983
title: Materials Data on H16S(N3O5)2 by Materials Project

description: (NH4)4(NO3)2SO4 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of sixteen ammonium molecules, eight nitric acid molecules, and four sulfuric acid molecules.
DOI: 10.17188/1664984
title: Materials Data on PrSb2 by Materials Project

description: PrSb2 crystallizes in the orthorhombic Cmce space group. The structure is three-dimensional. Pr3+ is bonded in a 9-coordinate geometry to nine Sb+1.50- atoms. There are a spread of Pr–Sb bond distances ranging from 3.21–3.50 Å. There are two inequivalent Sb+1.50- sites. In the first Sb+1.50- site, Sb+1.50- is bonded in a 6-coordinate geometry to five equivalent Pr3+ and one Sb+1.50- atom. The Sb–Sb bond length is 2.85 Å. In the second Sb+1.50- site, Sb+1.50- is bonded in a 8-coordinate geometry to four equivalent Pr3+ and four equivalent Sb+1.50- atoms. There are two shorter (3.11 Å) and two longer (3.18 Å) Sb–Sb bond lengths.
DOI: 10.17188/1664985
title: Materials Data on TlCuAs2PbS5 by Materials Project

description: CuTlPbAs2S5 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Cu1+ is bonded to four S2- atoms to form distorted edge-sharing CuS4 trigonal pyramids. There are a spread of Cu–S bond distances ranging from 2.26–2.94 Å. Tl1+ is bonded in a 2-coordinate geometry to eight S2- atoms. There are a spread of Tl–S bond distances ranging from 3.04–3.92 Å. Pb2+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Pb–S bond distances ranging from 2.80–3.53 Å. There are two inequivalent As3+ sites. In the first As3+ site, As3+ is bonded in a trigonal non-coplanar geometry to three S2- atoms. There are a spread of As–S bond distances ranging from 2.26–2.36 Å. In the second As3+ site, As3+ is bonded in a trigonal non-coplanar geometry to three S2- atoms. There are a spread of As–S bond distances ranging from 2.27–2.32 Å. There are five inequivalent S2- sites. In the first S2- site, S2- is bonded in a distorted L-shaped geometry to one Tl1+, two equivalent Pb2+, and two As3+ atoms. In the second S2- site, S2- is bonded in a 2-coordinate geometry to two equivalent Cu1+, two equivalent Tl1+, one Pb2+, and one As3+ atom. In the third S2- site, S2- is bonded in a 4-coordinate geometry to one Tl1+, two equivalent Pb2+, and one As3+ atom. In the fourth S2- site, S2- is bonded in a 3-coordinate geometry to one Cu1+, two equivalent Tl1+, one Pb2+, and one As3+ atom. In the fifth S2- site, S2- is bonded in a distorted water-like geometry to one Cu1+, two equivalent Tl1+, two equivalent Pb2+, and one As3+ atom.
DOI: 10.17188/1664986
title: Materials Data on Rb(CuO5)2 by Materials Project

description: Rb(CuO5)2 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Rb is bonded in a 6-coordinate geometry to six O atoms. There are two shorter (2.81 Å) and four longer (3.04 Å) Rb–O bond lengths. Cu is bonded in a distorted square co-planar geometry to six O atoms. There are a spread of Cu–O bond distances ranging from 1.81–2.61 Å. There are four inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one Rb, one Cu, and one O atom. The O–O bond length is 1.39 Å. In the second O site, O is bonded in a bent 120 degrees geometry to two equivalent O atoms. In the third O site, O is bonded in a distorted trigonal non-coplanar geometry to two equivalent Cu and one O atom. The O–O bond length is 1.25 Å. In the fourth O site, O is bonded in a distorted bent 120 degrees geometry to one Rb and two equivalent Cu atoms.
DOI: 10.17188/1664987
title: Materials Data on KLi6BiO6 by Materials Project

description: Li6KBiO6 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. K1+ is bonded in a distorted hexagonal planar geometry to six O2- atoms. There are four shorter (2.82 Å) and two longer (2.96 Å) K–O bond lengths. There are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a T-shaped geometry to three O2- atoms. There are a spread of Li–O bond distances ranging from 1.88–2.01 Å. In the second Li1+ site, Li1+ is bonded in a water-like geometry to two equivalent O2- atoms. Both Li–O bond lengths are 1.81 Å. Bi5+ is bonded in an octahedral geometry to six O2- atoms. There are two shorter (2.12 Å) and four longer (2.22 Å) Bi–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to one K1+, three Li1+, and one Bi5+ atom. In the second O2- site, O2- is bonded to one K1+, two equivalent Li1+, and one Bi5+ atom to form distorted corner-sharing OKLi2Bi trigonal pyramids.
DOI: 10.17188/1664988
title: Materials Data on Li3Mn2SnO6 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: 10.17188/1664989
title: Materials Data on Na5LiCo2P2(CO7)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: 10.17188/1664990
title: Materials Data on K2W2O15 by Materials Project

description: K2W2O15 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent K sites. In the first K site, K is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of K–O bond distances ranging from 2.65–3.13 Å. In the second K site, K is bonded in a 6-coordinate geometry to six O atoms. There are a spread of K–O bond distances ranging from 2.68–3.08 Å. There are two inequivalent W sites. In the first W site, W is bonded to five O atoms to form distorted corner-sharing WO5 trigonal bipyramids. There are a spread of W–O bond distances ranging from 1.77–2.12 Å. In the second W site, W is bonded to seven O atoms to form distorted WO7 pentagonal bipyramids that share a cornercorner with one OK2WO tetrahedra and a cornercorner with one WO5 trigonal bipyramid. There are a spread of W–O bond distances ranging from 1.81–2.22 Å. There are fifteen inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to one K and one W atom. In the second O site, O is bonded in a bent 120 degrees geometry to one K and one O atom. The O–O bond length is 1.23 Å. In the third O site, O is bonded in a bent 150 degrees geometry to one K and one O atom. In the fourth O site, O is bonded in a distorted water-like geometry to one W and one O atom. The O–O bond length is 1.34 Å. In the fifth O site, O is bonded in a 3-coordinate geometry to two equivalent K and one O atom. In the sixth O site, O is bonded in a distorted bent 150 degrees geometry to one K and one O atom. The O–O bond length is 1.33 Å. In the seventh O site, O is bonded in a trigonal planar geometry to one K, one W, and one O atom. In the eighth O site, O is bonded in a 2-coordinate geometry to one W and one O atom. The O–O bond length is 1.36 Å. In the ninth O site, O is bonded in a distorted T-shaped geometry to one K, one W, and one O atom. In the tenth O site, O is bonded to two K, one W, and one O atom to form distorted OK2WO tetrahedra that share a cornercorner with one WO7 pentagonal bipyramid. The O–O bond length is 1.35 Å. In the eleventh O site, O is bonded in a 2-coordinate geometry to one W and one O atom. In the twelfth O site, O is bonded in a distorted single-bond geometry to two K and one W atom. In the thirteenth O site, O is bonded in a bent 150 degrees geometry to one K and one W atom. In the fourteenth O site, O is bonded in a bent 150 degrees geometry to two W atoms. In the fifteenth O site, O is bonded in a distorted single-bond geometry to one K and one W atom.
DOI: 10.17188/1664991
title: Materials Data on TbMnFe by Materials Project

description: TbMnFe crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to six equivalent Mn and six equivalent Fe atoms. There are four shorter (3.00 Å) and two longer (3.03 Å) Tb–Mn bond lengths. There are two shorter (3.00 Å) and four longer (3.04 Å) Tb–Fe bond lengths. Mn is bonded to six equivalent Tb, two equivalent Mn, and four equivalent Fe atoms to form MnTb6Mn2Fe4 cuboctahedra that share corners with eight equivalent FeTb6Mn4Fe2 cuboctahedra, corners with ten equivalent MnTb6Mn2Fe4 cuboctahedra, edges with six equivalent MnTb6Mn2Fe4 cuboctahedra, faces with six equivalent MnTb6Mn2Fe4 cuboctahedra, and faces with twelve equivalent FeTb6Mn4Fe2 cuboctahedra. Both Mn–Mn bond lengths are 2.61 Å. All Mn–Fe bond lengths are 2.57 Å. Fe is bonded to six equivalent Tb, four equivalent Mn, and two equivalent Fe atoms to form FeTb6Mn4Fe2 cuboctahedra that share corners with eight equivalent MnTb6Mn2Fe4 cuboctahedra, corners with ten equivalent FeTb6Mn4Fe2 cuboctahedra, edges with six equivalent FeTb6Mn4Fe2 cuboctahedra, faces with six equivalent FeTb6Mn4Fe2 cuboctahedra, and faces with twelve equivalent MnTb6Mn2Fe4 cuboctahedra. Both Fe–Fe bond lengths are 2.54 Å.
DOI: 10.17188/1664994
title: Materials Data on Gd2CoB3 by Materials Project

description: Gd2CoB3 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Gd3+ is bonded in a 9-coordinate geometry to nine B3- atoms. There are six shorter (2.75 Å) and three longer (2.92 Å) Gd–B bond lengths. Co3+ is bonded in a trigonal planar geometry to three equivalent B3- atoms. All Co–B bond lengths are 1.96 Å. There are three inequivalent B3- sites. In the first B3- site, B3- is bonded in a 9-coordinate geometry to six equivalent Gd3+ and three equivalent B3- atoms. All B–B bond lengths are 1.96 Å. In the second B3- site, B3- is bonded in a distorted trigonal planar geometry to six equivalent Gd3+ and three equivalent Co3+ atoms. In the third B3- site, B3- is bonded in a 9-coordinate geometry to six equivalent Gd3+ and three equivalent B3- atoms.
DOI: 10.17188/1664995
title: Materials Data on K2Cr3O10 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: 10.17188/1664996
title: Materials Data on Tb5(Ge5Ir2)2 by Materials Project

description: Tb5(Ir2Ge5)2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. there are three inequivalent Tb sites. In the first Tb site, Tb is bonded in a 8-coordinate geometry to four equivalent Ir and twelve Ge atoms. All Tb–Ir bond lengths are 3.22 Å. There are eight shorter (3.00 Å) and four longer (3.37 Å) Tb–Ge bond lengths. In the second Tb site, Tb is bonded to four equivalent Ir and eight Ge atoms to form face-sharing TbGe8Ir4 cuboctahedra. All Tb–Ir bond lengths are 3.14 Å. There are a spread of Tb–Ge bond distances ranging from 2.96–3.09 Å. In the third Tb site, Tb is bonded in a 8-coordinate geometry to four equivalent Ir and ten Ge atoms. All Tb–Ir bond lengths are 3.35 Å. There are eight shorter (3.30 Å) and two longer (3.37 Å) Tb–Ge bond lengths. Ir is bonded in a 10-coordinate geometry to five Tb and five Ge atoms. There are a spread of Ir–Ge bond distances ranging from 2.48–2.57 Å. There are three inequivalent Ge sites. In the first Ge site, Ge is bonded in a 9-coordinate geometry to six Tb, two equivalent Ir, and one Ge atom. The Ge–Ge bond length is 2.46 Å. In the second Ge site, Ge is bonded in a 2-coordinate geometry to five Tb, two equivalent Ir, and one Ge atom. The Ge–Ge bond length is 2.53 Å. In the third Ge site, Ge is bonded in a 8-coordinate geometry to four Tb, two equivalent Ir, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.91 Å.