cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1196477
title: Materials Data on LaGa3Pd2 by Materials Project

description: LaPd2Ga3 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. La is bonded in a distorted hexagonal planar geometry to six equivalent Pd and twelve equivalent Ga atoms. All La–Pd bond lengths are 3.16 Å. All La–Ga bond lengths are 3.49 Å. Pd is bonded in a 9-coordinate geometry to three equivalent La and six equivalent Ga atoms. All Pd–Ga bond lengths are 2.68 Å. Ga is bonded to four equivalent La and four equivalent Pd atoms to form a mixture of distorted edge, face, and corner-sharing GaLa4Pd4 cuboctahedra.
DOI: 10.17188/1196478
title: Materials Data on Sm3In by Materials Project

description: Sm3In is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sm is bonded to eight equivalent Sm and four equivalent In atoms to form distorted SmSm8In4 cuboctahedra that share corners with twelve equivalent SmSm8In4 cuboctahedra, edges with eight equivalent InSm12 cuboctahedra, edges with sixteen equivalent SmSm8In4 cuboctahedra, faces with four equivalent InSm12 cuboctahedra, and faces with fourteen equivalent SmSm8In4 cuboctahedra. All Sm–Sm bond lengths are 3.49 Å. All Sm–In bond lengths are 3.49 Å. In is bonded to twelve equivalent Sm atoms to form InSm12 cuboctahedra that share corners with twelve equivalent InSm12 cuboctahedra, edges with twenty-four equivalent SmSm8In4 cuboctahedra, faces with six equivalent InSm12 cuboctahedra, and faces with twelve equivalent SmSm8In4 cuboctahedra.
DOI: 10.17188/1196479
title: Materials Data on TbCoSi by Materials Project

description: TbCoSi is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Tb3+ is bonded in a 5-coordinate geometry to five equivalent Si4- atoms. There are four shorter (2.96 Å) and one longer (3.32 Å) Tb–Si bond lengths. Co1+ is bonded to four equivalent Si4- atoms to form a mixture of edge and corner-sharing CoSi4 tetrahedra. All Co–Si bond lengths are 2.34 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Tb3+ and four equivalent Co1+ atoms.
DOI: 10.17188/1196480
title: Materials Data on ZrNiP by Materials Project

description: ZrNiP crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Zr2+ is bonded to five equivalent P3- atoms to form ZrP5 trigonal bipyramids that share corners with twelve equivalent NiP6 octahedra, corners with eight equivalent ZrP5 trigonal bipyramids, edges with six equivalent ZrP5 trigonal bipyramids, and faces with six equivalent NiP6 octahedra. The corner-sharing octahedra tilt angles range from 26–64°. There are two shorter (2.61 Å) and three longer (2.62 Å) Zr–P bond lengths. Ni1+ is bonded to six equivalent P3- atoms to form distorted NiP6 octahedra that share corners with twelve equivalent NiP6 octahedra, corners with twelve equivalent ZrP5 trigonal bipyramids, edges with six equivalent NiP6 octahedra, faces with two equivalent NiP6 octahedra, and faces with six equivalent ZrP5 trigonal bipyramids. The corner-sharing octahedral tilt angles are 53°. All Ni–P bond lengths are 2.93 Å. P3- is bonded to five equivalent Zr2+ and six equivalent Ni1+ atoms to form a mixture of distorted corner and face-sharing PZr5Ni6 trigonal bipyramids.
DOI: 10.17188/1196481
title: Materials Data on Tm2InPd2 by Materials Project

description: Tm2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Tm is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.84 Å) and four longer (2.97 Å) Tm–Pd bond lengths. All Tm–In bond lengths are 3.38 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Tm, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.79 Å. Both Pd–In bond lengths are 3.02 Å. In is bonded to eight equivalent Tm and four equivalent Pd atoms to form a mixture of corner and face-sharing InTm8Pd4 cuboctahedra.
DOI: 10.17188/1196482
title: Materials Data on Yb3GaC by Materials Project

description: Yb3GaC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Yb is bonded in a linear geometry to four equivalent Ga and two equivalent C atoms. All Yb–Ga bond lengths are 3.52 Å. Both Yb–C bond lengths are 2.49 Å. Ga is bonded to twelve equivalent Yb atoms to form GaYb12 cuboctahedra that share corners with twelve equivalent GaYb12 cuboctahedra, faces with six equivalent GaYb12 cuboctahedra, and faces with eight equivalent CYb6 octahedra. C is bonded to six equivalent Yb atoms to form CYb6 octahedra that share corners with six equivalent CYb6 octahedra and faces with eight equivalent GaYb12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196483
title: Materials Data on LaInNi2 by Materials Project

description: LaNi2In crystallizes in the orthorhombic Pmma space group. The structure is three-dimensional. La is bonded in a 1-coordinate geometry to seven Ni and six equivalent In atoms. There are a spread of La–Ni bond distances ranging from 2.72–3.13 Å. There are four shorter (3.39 Å) and two longer (3.46 Å) La–In bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 9-coordinate geometry to three equivalent La, four equivalent Ni, and two equivalent In atoms. All Ni–Ni bond lengths are 2.57 Å. Both Ni–In bond lengths are 2.66 Å. In the second Ni site, Ni is bonded to four equivalent La, six Ni, and two equivalent In atoms to form a mixture of edge, corner, and face-sharing NiLa4In2Ni6 cuboctahedra. Both Ni–Ni bond lengths are 2.64 Å. Both Ni–In bond lengths are 2.78 Å. In is bonded in a 12-coordinate geometry to six equivalent La and four Ni atoms.
DOI: 10.17188/1196484
title: Materials Data on RhF3 by Materials Project

description: RhF3 crystallizes in the trigonal P321 space group. The structure is three-dimensional. there are two inequivalent Rh3+ sites. In the first Rh3+ site, Rh3+ is bonded to six F1- atoms to form corner-sharing RhF6 octahedra. The corner-sharing octahedral tilt angles are 45°. There are three shorter (1.98 Å) and three longer (2.02 Å) Rh–F bond lengths. In the second Rh3+ site, Rh3+ is bonded to six equivalent F1- atoms to form distorted corner-sharing RhF6 pentagonal pyramids. The corner-sharing octahedral tilt angles are 38°. All Rh–F bond lengths are 2.06 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a bent 150 degrees geometry to two Rh3+ atoms. In the second F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two equivalent Rh3+ atoms.
DOI: 10.17188/1196485
title: Materials Data on Cu3(AsO4)2 by Materials Project

description: Cu3(AsO4)2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Cu2+ sites. In the first Cu2+ site, Cu2+ is bonded in a square co-planar geometry to four O2- atoms. There is two shorter (1.92 Å) and two longer (1.98 Å) Cu–O bond length. In the second Cu2+ site, Cu2+ is bonded to five O2- atoms to form distorted CuO5 trigonal bipyramids that share corners with five equivalent AsO4 tetrahedra and an edgeedge with one CuO5 trigonal bipyramid. There are a spread of Cu–O bond distances ranging from 1.94–2.50 Å. As5+ is bonded to four O2- atoms to form AsO4 tetrahedra that share corners with five equivalent CuO5 trigonal bipyramids. There are a spread of As–O bond distances ranging from 1.70–1.77 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Cu2+ and one As5+ atom. In the second O2- site, O2- is bonded in a trigonal planar geometry to two Cu2+ and one As5+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two Cu2+ and one As5+ atom. In the fourth O2- site, O2- is bonded in a bent 120 degrees geometry to one Cu2+ and one As5+ atom.
DOI: 10.17188/1196486
title: Materials Data on ScAl3 by Materials Project

description: Al3Sc is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sc is bonded to twelve equivalent Al atoms to form ScAl12 cuboctahedra that share corners with twelve equivalent ScAl12 cuboctahedra, edges with twenty-four equivalent AlSc4Al8 cuboctahedra, faces with six equivalent ScAl12 cuboctahedra, and faces with twelve equivalent AlSc4Al8 cuboctahedra. All Sc–Al bond lengths are 2.90 Å. Al is bonded to four equivalent Sc and eight equivalent Al atoms to form AlSc4Al8 cuboctahedra that share corners with twelve equivalent AlSc4Al8 cuboctahedra, edges with eight equivalent ScAl12 cuboctahedra, edges with sixteen equivalent AlSc4Al8 cuboctahedra, faces with four equivalent ScAl12 cuboctahedra, and faces with fourteen equivalent AlSc4Al8 cuboctahedra. All Al–Al bond lengths are 2.90 Å.
DOI: 10.17188/1196487
title: Materials Data on InSb by Materials Project

description: InSb is Halite, Rock Salt-like structured and crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. In3+ is bonded to six equivalent Sb3- atoms to form a mixture of edge and corner-sharing InSb6 octahedra. The corner-sharing octahedra tilt angles range from 0–13°. There are a spread of In–Sb bond distances ranging from 3.06–3.09 Å. Sb3- is bonded to six equivalent In3+ atoms to form a mixture of edge and corner-sharing SbIn6 octahedra. The corner-sharing octahedra tilt angles range from 0–13°.
DOI: 10.17188/1196488
title: Materials Data on InFeCo2 by Materials Project

description: Co2FeIn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Fe is bonded in a distorted body-centered cubic geometry to eight equivalent Co atoms. All Fe–Co bond lengths are 2.59 Å. Co is bonded in a body-centered cubic geometry to four equivalent Fe and four equivalent In atoms. All Co–In bond lengths are 2.59 Å. In is bonded in a body-centered cubic geometry to eight equivalent Co atoms.
DOI: 10.17188/1196489
title: Materials Data on PbSe by Materials Project

description: PbSe is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pb2+ is bonded in a body-centered cubic geometry to eight equivalent Se2- atoms. All Pb–Se bond lengths are 3.28 Å. Se2- is bonded in a body-centered cubic geometry to eight equivalent Pb2+ atoms.
DOI: 10.17188/1196490
title: Materials Data on InPd by Materials Project

description: PdIn is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pd is bonded in a body-centered cubic geometry to eight equivalent In atoms. All Pd–In bond lengths are 2.87 Å. In is bonded in a body-centered cubic geometry to eight equivalent Pd atoms.
DOI: 10.17188/1196491
title: Materials Data on URhS3 by Materials Project

description: URhS3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. U3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of U–S bond distances ranging from 2.66–2.93 Å. Rh3+ is bonded to six S2- atoms to form corner-sharing RhS6 octahedra. The corner-sharing octahedra tilt angles range from 42–54°. There are a spread of Rh–S bond distances ranging from 2.37–2.51 Å. There are two inequivalent S2- sites. In the first S2- site, S2- is bonded in a 5-coordinate geometry to three equivalent U3+ and two equivalent Rh3+ atoms. In the second S2- site, S2- is bonded in a distorted see-saw-like geometry to two equivalent U3+ and two equivalent Rh3+ atoms.
DOI: 10.17188/1196492
title: Materials Data on La(GePt)2 by Materials Project

description: LaPt2Ge2 crystallizes in the monoclinic P2_1 space group. The structure is three-dimensional. La is bonded in a 1-coordinate geometry to eight Pt and eight Ge atoms. There are a spread of La–Pt bond distances ranging from 3.34–3.42 Å. There are a spread of La–Ge bond distances ranging from 3.32–3.43 Å. There are two inequivalent Pt sites. In the first Pt site, Pt is bonded in a 4-coordinate geometry to four equivalent La and four equivalent Ge atoms. There are a spread of Pt–Ge bond distances ranging from 2.56–2.58 Å. In the second Pt site, Pt is bonded in a 5-coordinate geometry to four equivalent La and five Ge atoms. There are one shorter (2.50 Å) and four longer (2.55 Å) Pt–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 4-coordinate geometry to four equivalent La and four equivalent Pt atoms. In the second Ge site, Ge is bonded in a 5-coordinate geometry to four equivalent La and five Pt atoms.
DOI: 10.17188/1196493
title: Materials Data on CaIn4Rh by Materials Project

description: CaRhIn4 crystallizes in the orthorhombic Pmma space group. The structure is three-dimensional. Ca is bonded in a 1-coordinate geometry to one Rh and twelve In atoms. The Ca–Rh bond length is 3.08 Å. There are a spread of Ca–In bond distances ranging from 3.32–3.75 Å. Rh is bonded in a 9-coordinate geometry to one Ca and eight In atoms. There are a spread of Rh–In bond distances ranging from 2.64–2.92 Å. There are three inequivalent In sites. In the first In site, In is bonded in a linear geometry to two equivalent Ca and two equivalent Rh atoms. In the second In site, In is bonded in a distorted rectangular see-saw-like geometry to two equivalent Ca and two equivalent Rh atoms. In the third In site, In is bonded in a 2-coordinate geometry to four equivalent Ca and two equivalent Rh atoms.
DOI: 10.17188/1196494
title: Materials Data on Pr(FeGe)2 by Materials Project

description: PrFe2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Pr is bonded in a 8-coordinate geometry to eight equivalent Fe and eight equivalent Ge atoms. All Pr–Fe bond lengths are 3.38 Å. All Pr–Ge bond lengths are 3.16 Å. Fe is bonded to four equivalent Pr and four equivalent Ge atoms to form a mixture of distorted corner, edge, and face-sharing FePr4Ge4 tetrahedra. All Fe–Ge bond lengths are 2.45 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Pr, four equivalent Fe, and one Ge atom. The Ge–Ge bond length is 2.65 Å.
DOI: 10.17188/1196495
title: Materials Data on Sm2InGe2 by Materials Project

description: Sm2InGe2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Sm is bonded in a 6-coordinate geometry to four equivalent In and six equivalent Ge atoms. All Sm–In bond lengths are 3.50 Å. There are two shorter (3.03 Å) and four longer (3.14 Å) Sm–Ge bond lengths. In is bonded to eight equivalent Sm and four equivalent Ge atoms to form a mixture of face and corner-sharing InSm8Ge4 cuboctahedra. All In–Ge bond lengths are 2.99 Å. Ge is bonded in a 9-coordinate geometry to six equivalent Sm, two equivalent In, and one Ge atom. The Ge–Ge bond length is 2.56 Å.
DOI: 10.17188/1196496
title: Materials Data on YbIn2Ni by Materials Project

description: YbNiIn2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Yb is bonded in a 1-coordinate geometry to three equivalent Ni and ten equivalent In atoms. There are one shorter (2.84 Å) and two longer (3.12 Å) Yb–Ni bond lengths. There are six shorter (3.31 Å) and four longer (3.41 Å) Yb–In bond lengths. Ni is bonded in a 9-coordinate geometry to three equivalent Yb and six equivalent In atoms. There are two shorter (2.69 Å) and four longer (2.75 Å) Ni–In bond lengths. In is bonded in a 12-coordinate geometry to five equivalent Yb, three equivalent Ni, and four equivalent In atoms. There are a spread of In–In bond distances ranging from 3.05–3.12 Å.
DOI: 10.17188/1196497
title: Materials Data on Sm(GeRu)2 by Materials Project

description: SmRu2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sm is bonded in a 8-coordinate geometry to eight equivalent Ru and eight equivalent Ge atoms. All Sm–Ru bond lengths are 3.30 Å. All Sm–Ge bond lengths are 3.31 Å. Ru is bonded in a 4-coordinate geometry to four equivalent Sm and four equivalent Ge atoms. All Ru–Ge bond lengths are 2.45 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Sm, four equivalent Ru, and one Ge atom. The Ge–Ge bond length is 2.64 Å.
DOI: 10.17188/1196498
title: Materials Data on Pu(SiOs)2 by Materials Project

description: PuOs2Si2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Pu4+ is bonded in a 8-coordinate geometry to eight equivalent Os2- atoms. All Pu–Os bond lengths are 3.18 Å. Os2- is bonded in a 4-coordinate geometry to four equivalent Pu4+ and four equivalent Si atoms. All Os–Si bond lengths are 2.40 Å. Si is bonded in a 5-coordinate geometry to four equivalent Os2- and one Si atom. The Si–Si bond length is 2.38 Å.
DOI: 10.17188/1196499
title: Materials Data on U3TiSb5 by Materials Project

description: U3TiSb5 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. U+3.67+ is bonded in a 9-coordinate geometry to nine Sb3- atoms. There are a spread of U–Sb bond distances ranging from 3.14–3.27 Å. Ti4+ is bonded to six equivalent Sb3- atoms to form face-sharing TiSb6 octahedra. All Ti–Sb bond lengths are 2.84 Å. There are two inequivalent Sb3- sites. In the first Sb3- site, Sb3- is bonded in a 8-coordinate geometry to six equivalent U+3.67+ and two equivalent Sb3- atoms. Both Sb–Sb bond lengths are 3.06 Å. In the second Sb3- site, Sb3- is bonded to five equivalent U+3.67+ and two equivalent Ti4+ atoms to form a mixture of distorted corner, edge, and face-sharing SbU5Ti2 pentagonal bipyramids.
DOI: 10.17188/1196500
title: Materials Data on SrCuSeF by Materials Project

description: SrCuFSe is Parent of FeAs superconductors structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Sr2+ is bonded in a 4-coordinate geometry to four equivalent Se2- and four equivalent F1- atoms. All Sr–Se bond lengths are 3.26 Å. All Sr–F bond lengths are 2.50 Å. Cu1+ is bonded to four equivalent Se2- atoms to form a mixture of edge and corner-sharing CuSe4 tetrahedra. All Cu–Se bond lengths are 2.54 Å. Se2- is bonded in a 12-coordinate geometry to four equivalent Sr2+ and four equivalent Cu1+ atoms. F1- is bonded to four equivalent Sr2+ atoms to form a mixture of edge and corner-sharing FSr4 tetrahedra.
DOI: 10.17188/1196501
title: Materials Data on Eu(SiAu)2 by Materials Project

description: Eu(AuSi)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Eu2+ is bonded in a 8-coordinate geometry to eight equivalent Au1- atoms. All Eu–Au bond lengths are 3.37 Å. Au1- is bonded to four equivalent Eu2+ and four equivalent Si atoms to form a mixture of distorted edge, face, and corner-sharing AuEu4Si4 tetrahedra. All Au–Si bond lengths are 2.59 Å. Si is bonded in a 5-coordinate geometry to four equivalent Au1- and one Si atom. The Si–Si bond length is 2.35 Å.
DOI: 10.17188/1196502
title: Materials Data on Nb3Au2 by Materials Project

description: Au2Nb3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Nb sites. In the first Nb site, Nb is bonded in a 10-coordinate geometry to eight equivalent Nb and two equivalent Au atoms. All Nb–Nb bond lengths are 2.87 Å. Both Nb–Au bond lengths are 3.07 Å. In the second Nb site, Nb is bonded in a 10-coordinate geometry to four equivalent Nb and five equivalent Au atoms. There are four shorter (2.87 Å) and one longer (3.11 Å) Nb–Au bond lengths. Au is bonded in a 10-coordinate geometry to six Nb and four equivalent Au atoms. All Au–Au bond lengths are 2.89 Å.
DOI: 10.17188/1196503
title: Materials Data on GdCoB4 by Materials Project

description: GdCoB4 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. Gd3+ is bonded in a 2-coordinate geometry to fourteen B+1.50- atoms. There are a spread of Gd–B bond distances ranging from 2.59–2.72 Å. Co3+ is bonded in a 10-coordinate geometry to ten B+1.50- atoms. There are a spread of Co–B bond distances ranging from 2.20–2.30 Å. There are four inequivalent B+1.50- sites. In the first B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to four equivalent Gd3+, two equivalent Co3+, and three B+1.50- atoms. There are a spread of B–B bond distances ranging from 1.74–1.86 Å. In the second B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to two equivalent Gd3+, four equivalent Co3+, and three B+1.50- atoms. There is one shorter (1.68 Å) and one longer (1.73 Å) B–B bond length. In the third B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to four equivalent Gd3+, two equivalent Co3+, and three B+1.50- atoms. The B–B bond length is 1.80 Å. In the fourth B+1.50- site, B+1.50- is bonded in a 9-coordinate geometry to four equivalent Gd3+, two equivalent Co3+, and three B+1.50- atoms. The B–B bond length is 1.82 Å.
DOI: 10.17188/1196504
title: Materials Data on FeSn2(CN)6 by Materials Project

description: Sn2Fe(CN)6 crystallizes in the trigonal P-3 space group. The structure is two-dimensional and consists of one Sn2Fe(CN)6 sheet oriented in the (0, 0, 1) direction. Fe2+ is bonded in an octahedral geometry to six equivalent C+1.33+ atoms. All Fe–C bond lengths are 1.88 Å. Sn4+ is bonded in a distorted T-shaped geometry to three equivalent N3- atoms. All Sn–N bond lengths are 2.26 Å. C+1.33+ is bonded in a linear geometry to one Fe2+ and one N3- atom. The C–N bond length is 1.18 Å. N3- is bonded in a bent 150 degrees geometry to one Sn4+ and one C+1.33+ atom.
DOI: 10.17188/1196505
title: Materials Data on TmInRh by Materials Project

description: TmRhIn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Tm is bonded in a 11-coordinate geometry to five Rh and six equivalent In atoms. There are four shorter (3.00 Å) and one longer (3.03 Å) Tm–Rh bond lengths. There are two shorter (3.18 Å) and four longer (3.30 Å) Tm–In bond lengths. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 9-coordinate geometry to six equivalent Tm and three equivalent In atoms. All Rh–In bond lengths are 2.81 Å. In the second Rh site, Rh is bonded in a 9-coordinate geometry to three equivalent Tm and six equivalent In atoms. All Rh–In bond lengths are 2.75 Å. In is bonded in a 4-coordinate geometry to six equivalent Tm and four Rh atoms.
DOI: 10.17188/1196506
title: Materials Data on Ti3InN by Materials Project

description: Ti3InN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ti is bonded in a linear geometry to four equivalent In and two equivalent N atoms. All Ti–In bond lengths are 2.97 Å. Both Ti–N bond lengths are 2.10 Å. In is bonded to twelve equivalent Ti atoms to form InTi12 cuboctahedra that share corners with twelve equivalent InTi12 cuboctahedra, faces with six equivalent InTi12 cuboctahedra, and faces with eight equivalent NTi6 octahedra. N is bonded to six equivalent Ti atoms to form NTi6 octahedra that share corners with six equivalent NTi6 octahedra and faces with eight equivalent InTi12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196507
title: Materials Data on EuZnSi by Materials Project

description: EuZnSi crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Eu2+ is bonded to six equivalent Si4- atoms to form a mixture of edge, corner, and face-sharing EuSi6 octahedra. The corner-sharing octahedral tilt angles are 45°. All Eu–Si bond lengths are 3.23 Å. Zn2+ is bonded in a trigonal planar geometry to three equivalent Si4- atoms. All Zn–Si bond lengths are 2.45 Å. Si4- is bonded in a distorted trigonal planar geometry to six equivalent Eu2+ and three equivalent Zn2+ atoms.