cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1196363
title: Materials Data on Fe2GeS4 by Materials Project

description: Fe2GeS4 is Spinel-like structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Fe2+ sites. In the first Fe2+ site, Fe2+ is bonded to six S2- atoms to form FeS6 octahedra that share corners with four equivalent FeS6 octahedra, corners with two equivalent GeS4 tetrahedra, edges with four FeS6 octahedra, and edges with two equivalent GeS4 tetrahedra. The corner-sharing octahedra tilt angles range from 49–50°. There are a spread of Fe–S bond distances ranging from 2.20–2.38 Å. In the second Fe2+ site, Fe2+ is bonded to six S2- atoms to form FeS6 octahedra that share corners with eight FeS6 octahedra, corners with four equivalent GeS4 tetrahedra, edges with two equivalent FeS6 octahedra, and an edgeedge with one GeS4 tetrahedra. The corner-sharing octahedra tilt angles range from 47–50°. There are a spread of Fe–S bond distances ranging from 2.22–2.51 Å. Ge4+ is bonded to four S2- atoms to form distorted GeS4 tetrahedra that share corners with six FeS6 octahedra and edges with three FeS6 octahedra. The corner-sharing octahedra tilt angles range from 67–69°. There are three shorter (2.26 Å) and one longer (2.27 Å) Ge–S bond lengths. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a rectangular see-saw-like geometry to three Fe2+ and one Ge4+ atom. In the second S2- site, S2- is bonded to three Fe2+ and one Ge4+ atom to form corner-sharing SFe3Ge tetrahedra. In the third S2- site, S2- is bonded in a rectangular see-saw-like geometry to three Fe2+ and one Ge4+ atom.
DOI: 10.17188/1196364
title: Materials Data on UAs by Materials Project

description: UAs is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. U3+ is bonded in a body-centered cubic geometry to eight equivalent As3- atoms. All U–As bond lengths are 3.04 Å. As3- is bonded in a body-centered cubic geometry to eight equivalent U3+ atoms.
DOI: 10.17188/1196365
title: Materials Data on Ce(MnGe)2 by Materials Project

description: CeMn2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Mn and eight equivalent Ge atoms. All Ce–Mn bond lengths are 3.36 Å. All Ce–Ge bond lengths are 3.11 Å. Mn is bonded to four equivalent Ce and four equivalent Ge atoms to form a mixture of face, edge, and corner-sharing MnCe4Ge4 tetrahedra. All Mn–Ge bond lengths are 2.44 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Ce, four equivalent Mn, and one Ge atom. The Ge–Ge bond length is 2.62 Å.
DOI: 10.17188/1196366
title: Materials Data on CePt2 by Materials Project

description: CePt2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ce4+ is bonded in a 12-coordinate geometry to twelve equivalent Pt2- atoms. All Ce–Pt bond lengths are 3.22 Å. Pt2- is bonded to six equivalent Ce4+ and six equivalent Pt2- atoms to form a mixture of corner, edge, and face-sharing PtCe6Pt6 cuboctahedra. All Pt–Pt bond lengths are 2.75 Å.
DOI: 10.17188/1196367
title: Materials Data on MnNiGe by Materials Project

description: MnNiGe crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Mn is bonded in a 12-coordinate geometry to two equivalent Mn, six equivalent Ni, and six equivalent Ge atoms. Both Mn–Mn bond lengths are 2.65 Å. All Mn–Ni bond lengths are 2.71 Å. All Mn–Ge bond lengths are 2.71 Å. Ni is bonded in a 11-coordinate geometry to six equivalent Mn and five equivalent Ge atoms. There are three shorter (2.36 Å) and two longer (2.65 Å) Ni–Ge bond lengths. Ge is bonded in a 11-coordinate geometry to six equivalent Mn and five equivalent Ni atoms.
DOI: 10.17188/1196368
title: Materials Data on InNi2 by Materials Project

description: Ni2In crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 8-coordinate geometry to eight Ni and six equivalent In atoms. There are two shorter (2.63 Å) and six longer (2.81 Å) Ni–Ni bond lengths. All Ni–In bond lengths are 2.81 Å. In the second Ni site, Ni is bonded to six equivalent Ni and five equivalent In atoms to form a mixture of distorted corner and face-sharing NiIn5Ni6 trigonal bipyramids. There are three shorter (2.49 Å) and two longer (2.63 Å) Ni–In bond lengths. In is bonded in a 11-coordinate geometry to eleven Ni atoms.
DOI: 10.17188/1196369
title: Materials Data on SrPb by Materials Project

description: SrPb crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Sr is bonded in a 5-coordinate geometry to seven equivalent Pb atoms. There are a spread of Sr–Pb bond distances ranging from 3.50–3.74 Å. Pb is bonded in a 5-coordinate geometry to seven equivalent Sr and two equivalent Pb atoms. Both Pb–Pb bond lengths are 3.16 Å.
DOI: 10.17188/1196370
title: Materials Data on CaMnSi by Materials Project

description: CaMnSi is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is two-dimensional and consists of one CaMnSi sheet oriented in the (0, 0, 1) direction. Ca2+ is bonded to four equivalent Si4- atoms to form distorted CaSi4 trigonal pyramids that share corners with eight equivalent MnSi4 tetrahedra, corners with four equivalent CaSi4 trigonal pyramids, edges with four equivalent MnSi4 tetrahedra, and edges with four equivalent CaSi4 trigonal pyramids. All Ca–Si bond lengths are 3.02 Å. Mn2+ is bonded to four equivalent Si4- atoms to form MnSi4 tetrahedra that share corners with four equivalent MnSi4 tetrahedra, corners with eight equivalent CaSi4 trigonal pyramids, edges with four equivalent MnSi4 tetrahedra, and edges with four equivalent CaSi4 trigonal pyramids. All Mn–Si bond lengths are 2.39 Å. Si4- is bonded in a 8-coordinate geometry to four equivalent Ca2+ and four equivalent Mn2+ atoms.
DOI: 10.17188/1196371
title: Materials Data on KLaGeSe4 by Materials Project

description: KLaGeSe4 crystallizes in the monoclinic P2_1 space group. The structure is three-dimensional. K1+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of K–Se bond distances ranging from 3.45–3.92 Å. La3+ is bonded to seven Se2- atoms to form distorted LaSe7 pentagonal bipyramids that share corners with two equivalent LaSe7 pentagonal bipyramids, a cornercorner with one GeSe4 tetrahedra, edges with two equivalent LaSe7 pentagonal bipyramids, and edges with three equivalent GeSe4 tetrahedra. There are a spread of La–Se bond distances ranging from 3.05–3.21 Å. Ge4+ is bonded to four Se2- atoms to form GeSe4 tetrahedra that share a cornercorner with one LaSe7 pentagonal bipyramid and edges with three equivalent LaSe7 pentagonal bipyramids. There are one shorter (2.35 Å) and three longer (2.39 Å) Ge–Se bond lengths. There are four inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a distorted see-saw-like geometry to one K1+, two equivalent La3+, and one Ge4+ atom. In the second Se2- site, Se2- is bonded in a 5-coordinate geometry to two equivalent K1+, two equivalent La3+, and one Ge4+ atom. In the third Se2- site, Se2- is bonded in a 5-coordinate geometry to two equivalent K1+, two equivalent La3+, and one Ge4+ atom. In the fourth Se2- site, Se2- is bonded in a 5-coordinate geometry to three equivalent K1+, one La3+, and one Ge4+ atom.
DOI: 10.17188/1196372
title: Materials Data on UPb by Materials Project

description: UPb is Tetraauricupride structured and crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. U is bonded in a distorted body-centered cubic geometry to eight equivalent Pb atoms. All U–Pb bond lengths are 3.35 Å. Pb is bonded in a distorted body-centered cubic geometry to eight equivalent U atoms.
DOI: 10.17188/1196373
title: Materials Data on K2Pb(SO4)2 by Materials Project

description: K2Pb(SO4)2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. K1+ is bonded in a 10-coordinate geometry to ten O2- atoms. There are a spread of K–O bond distances ranging from 2.71–2.99 Å. Pb2+ is bonded in a 12-coordinate geometry to six equivalent O2- atoms. All Pb–O bond lengths are 2.67 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.48 Å) and three longer (1.50 Å) S–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent K1+, one Pb2+, and one S6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one K1+ and one S6+ atom.
DOI: 10.17188/1196381
title: Materials Data on U(SiPt)2 by Materials Project

description: UPt2Si2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. U4+ is bonded in a 8-coordinate geometry to eight Pt2- atoms. There are four shorter (3.20 Å) and four longer (3.27 Å) U–Pt bond lengths. There are two inequivalent Pt2- sites. In the first Pt2- site, Pt2- is bonded in a 5-coordinate geometry to four equivalent U4+ and five Si atoms. There are one shorter (2.39 Å) and four longer (2.42 Å) Pt–Si bond lengths. In the second Pt2- site, Pt2- is bonded to four equivalent U4+ and four equivalent Si atoms to form a mixture of distorted edge and face-sharing PtU4Si4 tetrahedra. All Pt–Si bond lengths are 2.49 Å. There are two inequivalent Si sites. In the first Si site, Si is bonded to four equivalent Pt2- atoms to form a mixture of edge and corner-sharing SiPt4 tetrahedra. In the second Si site, Si is bonded in a 5-coordinate geometry to five Pt2- atoms.
DOI: 10.17188/1196382
title: Materials Data on Yb2AlB6 by Materials Project

description: Yb2AlB6 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a 2-coordinate geometry to fourteen B atoms. There are a spread of Yb–B bond distances ranging from 2.65–2.77 Å. In the second Yb site, Yb is bonded in a 12-coordinate geometry to twelve B atoms. There are a spread of Yb–B bond distances ranging from 2.63–2.66 Å. Al is bonded in a 10-coordinate geometry to ten B atoms. There are a spread of Al–B bond distances ranging from 2.36–2.40 Å. There are six inequivalent B sites. In the first B site, B is bonded in a 9-coordinate geometry to four equivalent Yb, two equivalent Al, and three B atoms. There are a spread of B–B bond distances ranging from 1.80–1.84 Å. In the second B site, B is bonded in a 9-coordinate geometry to four Yb, two equivalent Al, and three B atoms. There are a spread of B–B bond distances ranging from 1.70–1.84 Å. In the third B site, B is bonded in a 9-coordinate geometry to four Yb, two equivalent Al, and three B atoms. There is one shorter (1.71 Å) and one longer (1.84 Å) B–B bond length. In the fourth B site, B is bonded in a 9-coordinate geometry to four Yb, two equivalent Al, and three B atoms. The B–B bond length is 1.82 Å. In the fifth B site, B is bonded in a 8-coordinate geometry to six Yb and two B atoms. In the sixth B site, B is bonded in a 9-coordinate geometry to four Yb, two equivalent Al, and three B atoms.
DOI: 10.17188/1196383
title: Materials Data on UPdSe3 by Materials Project

description: UPdSe3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. U4+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of U–Se bond distances ranging from 2.80–3.09 Å. Pd2+ is bonded to six Se2- atoms to form corner-sharing PdSe6 octahedra. The corner-sharing octahedra tilt angles range from 44–60°. There are a spread of Pd–Se bond distances ranging from 2.55–2.89 Å. There are two inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a 5-coordinate geometry to three equivalent U4+ and two equivalent Pd2+ atoms. In the second Se2- site, Se2- is bonded in a distorted see-saw-like geometry to two equivalent U4+ and two equivalent Pd2+ atoms.
DOI: 10.17188/1196384
title: Materials Data on Hf5Sn3 by Materials Project

description: Hf5Sn3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Hf sites. In the first Hf site, Hf is bonded in a 5-coordinate geometry to five equivalent Sn atoms. There are a spread of Hf–Sn bond distances ranging from 2.91–3.13 Å. In the second Hf site, Hf is bonded in a 6-coordinate geometry to six equivalent Sn atoms. All Hf–Sn bond lengths are 2.97 Å. Sn is bonded in a 9-coordinate geometry to nine Hf atoms.
DOI: 10.17188/1196385
title: Materials Data on PuSi2 by Materials Project

description: PuSi2 is hexagonal omega structure-like structured and crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Pu is bonded to twelve equivalent Si atoms to form a mixture of face and edge-sharing PuSi12 cuboctahedra. There are eight shorter (3.07 Å) and four longer (3.08 Å) Pu–Si bond lengths. Si is bonded in a 9-coordinate geometry to six equivalent Pu and three equivalent Si atoms. All Si–Si bond lengths are 2.33 Å.
DOI: 10.17188/1196386
title: Materials Data on LaYbS3 by Materials Project

description: YbLaS3 crystallizes in the orthorhombic Pna2_1 space group. The structure is three-dimensional. Yb3+ is bonded to six S2- atoms to form corner-sharing YbS6 octahedra. The corner-sharing octahedra tilt angles range from 41–68°. There are a spread of Yb–S bond distances ranging from 2.70–2.84 Å. La3+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of La–S bond distances ranging from 2.80–3.42 Å. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded in a 5-coordinate geometry to two equivalent Yb3+ and three equivalent La3+ atoms. In the second S2- site, S2- is bonded in a 5-coordinate geometry to two equivalent Yb3+ and three equivalent La3+ atoms. In the third S2- site, S2- is bonded in a distorted see-saw-like geometry to two equivalent Yb3+ and two equivalent La3+ atoms.
DOI: 10.17188/1196387
title: Materials Data on U6Fe by Materials Project

description: U6Fe crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent U sites. In the first U site, U is bonded in a distorted T-shaped geometry to thirteen U atoms. There are a spread of U–U bond distances ranging from 2.69–3.34 Å. In the second U site, U is bonded in a 4-coordinate geometry to five U and two equivalent Fe atoms. The U–U bond length is 2.61 Å. Both U–Fe bond lengths are 2.76 Å. Fe is bonded in a 10-coordinate geometry to eight equivalent U and two equivalent Fe atoms. Both Fe–Fe bond lengths are 2.63 Å.
DOI: 10.17188/1196388
title: Materials Data on LaAl4 by Materials Project

description: Al4La crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 8-coordinate geometry to sixteen Al atoms. There are a spread of La–Al bond distances ranging from 3.33–3.60 Å. In the second La site, La is bonded in a 8-coordinate geometry to sixteen Al atoms. There are a spread of La–Al bond distances ranging from 3.33–3.63 Å. There are eight inequivalent Al sites. In the first Al site, Al is bonded to four La and eight Al atoms to form a mixture of distorted face and corner-sharing AlLa4Al8 cuboctahedra. There are a spread of Al–Al bond distances ranging from 2.65–3.08 Å. In the second Al site, Al is bonded in a 9-coordinate geometry to four equivalent La and five Al atoms. There are a spread of Al–Al bond distances ranging from 2.57–2.66 Å. In the third Al site, Al is bonded in a 9-coordinate geometry to four La and five Al atoms. There are one shorter (2.57 Å) and three longer (2.66 Å) Al–Al bond lengths. In the fourth Al site, Al is bonded in a 12-coordinate geometry to four La and eight Al atoms. All Al–Al bond lengths are 3.11 Å. In the fifth Al site, Al is bonded in a 12-coordinate geometry to four La and eight Al atoms. The Al–Al bond length is 2.65 Å. In the sixth Al site, Al is bonded in a 9-coordinate geometry to four equivalent La and five Al atoms. Both Al–Al bond lengths are 2.67 Å. In the seventh Al site, Al is bonded in a 9-coordinate geometry to four La and five Al atoms. The Al–Al bond length is 2.66 Å. In the eighth Al site, Al is bonded to four La and eight Al atoms to form a mixture of distorted face and corner-sharing AlLa4Al8 cuboctahedra.
DOI: 10.17188/1196389
title: Materials Data on NdSnPt by Materials Project

description: NdPtSn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Nd is bonded in a 11-coordinate geometry to five Pt and six equivalent Sn atoms. There are four shorter (3.11 Å) and one longer (3.14 Å) Nd–Pt bond lengths. There are two shorter (3.31 Å) and four longer (3.44 Å) Nd–Sn bond lengths. There are two inequivalent Pt sites. In the first Pt site, Pt is bonded in a 9-coordinate geometry to three equivalent Nd and six equivalent Sn atoms. All Pt–Sn bond lengths are 2.84 Å. In the second Pt site, Pt is bonded in a 9-coordinate geometry to six equivalent Nd and three equivalent Sn atoms. All Pt–Sn bond lengths are 2.91 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Nd and four Pt atoms.
DOI: 10.17188/1196390
title: Materials Data on In2FeS4 by Materials Project

description: FeIn2S4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Fe2+ is bonded to four equivalent S2- atoms to form FeS4 tetrahedra that share corners with twelve equivalent InS6 octahedra. The corner-sharing octahedral tilt angles are 55°. All Fe–S bond lengths are 2.33 Å. In3+ is bonded to six equivalent S2- atoms to form InS6 octahedra that share corners with six equivalent FeS4 tetrahedra and edges with six equivalent InS6 octahedra. All In–S bond lengths are 2.66 Å. S2- is bonded in a distorted rectangular see-saw-like geometry to one Fe2+ and three equivalent In3+ atoms.
DOI: 10.17188/1196391
title: Materials Data on Y(FeGe)2 by Materials Project

description: YFe2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Y is bonded in a 8-coordinate geometry to eight equivalent Fe and eight equivalent Ge atoms. All Y–Fe bond lengths are 3.23 Å. All Y–Ge bond lengths are 3.10 Å. Fe is bonded to four equivalent Y and four equivalent Ge atoms to form a mixture of distorted edge, face, and corner-sharing FeY4Ge4 tetrahedra. All Fe–Ge bond lengths are 2.35 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Y, four equivalent Fe, and one Ge atom. The Ge–Ge bond length is 2.61 Å.
DOI: 10.17188/1196392
title: Materials Data on CeSi by Materials Project

description: CeSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce4+ is bonded in a 7-coordinate geometry to seven equivalent Si4- atoms. There are a spread of Ce–Si bond distances ranging from 3.03–3.20 Å. Si4- is bonded in a 9-coordinate geometry to seven equivalent Ce4+ and two equivalent Si4- atoms. Both Si–Si bond lengths are 2.48 Å.
DOI: 10.17188/1196393
title: Materials Data on CeCoGe3 by Materials Project

description: CeCoGe3 crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to five equivalent Co and twelve Ge atoms. There are one shorter (3.22 Å) and four longer (3.48 Å) Ce–Co bond lengths. There are a spread of Ce–Ge bond distances ranging from 3.11–3.35 Å. Co is bonded in a 5-coordinate geometry to five equivalent Ce and five Ge atoms. There are one shorter (2.28 Å) and four longer (2.33 Å) Co–Ge bond lengths. There are two inequivalent Ge sites. In the first Ge site, Ge is bonded in a 2-coordinate geometry to four equivalent Ce, two equivalent Co, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.76 Å. In the second Ge site, Ge is bonded in a 1-coordinate geometry to four equivalent Ce, one Co, and four equivalent Ge atoms.
DOI: 10.17188/1196394
title: Materials Data on FeGe2 by Materials Project

description: FeGe2 is Khatyrkite structured and crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Fe is bonded in a 10-coordinate geometry to two equivalent Fe and eight equivalent Ge atoms. Both Fe–Fe bond lengths are 2.47 Å. All Fe–Ge bond lengths are 2.55 Å. Ge is bonded in a 5-coordinate geometry to four equivalent Fe and one Ge atom. The Ge–Ge bond length is 2.63 Å.
DOI: 10.17188/1196395
title: Materials Data on Sr(MnGe)2 by Materials Project

description: Sr(MnGe)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sr is bonded in a distorted body-centered cubic geometry to eight equivalent Ge atoms. All Sr–Ge bond lengths are 3.27 Å. Mn is bonded to four equivalent Ge atoms to form a mixture of edge and corner-sharing MnGe4 tetrahedra. All Mn–Ge bond lengths are 2.44 Å. Ge is bonded in a 4-coordinate geometry to four equivalent Sr and four equivalent Mn atoms.
DOI: 10.17188/1196396
title: Materials Data on CeNiSn by Materials Project

description: CeNiSn crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce is bonded in a 1-coordinate geometry to six equivalent Ni and six equivalent Sn atoms. There are a spread of Ce–Ni bond distances ranging from 2.94–3.42 Å. There are a spread of Ce–Sn bond distances ranging from 3.17–3.32 Å. Ni is bonded in a 10-coordinate geometry to six equivalent Ce and four equivalent Sn atoms. There are a spread of Ni–Sn bond distances ranging from 2.63–2.85 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Ce and four equivalent Ni atoms.
DOI: 10.17188/1196397
title: Materials Data on NdSb2Pd by Materials Project

description: NdPdSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Nd3+ is bonded in a 8-coordinate geometry to eight Sb+2.50- atoms. There are four shorter (3.30 Å) and four longer (3.37 Å) Nd–Sb bond lengths. Pd2+ is bonded to four equivalent Sb+2.50- atoms to form a mixture of edge and corner-sharing PdSb4 tetrahedra. All Pd–Sb bond lengths are 2.72 Å. There are two inequivalent Sb+2.50- sites. In the first Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Nd3+ and four equivalent Pd2+ atoms. In the second Sb+2.50- site, Sb+2.50- is bonded in a 8-coordinate geometry to four equivalent Nd3+ and four equivalent Sb+2.50- atoms. All Sb–Sb bond lengths are 3.17 Å.
DOI: 10.17188/1196398
title: Materials Data on SrIn4Pt by Materials Project

description: SrPtIn4 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Sr is bonded in a 5-coordinate geometry to two equivalent Pt and thirteen In atoms. Both Sr–Pt bond lengths are 3.47 Å. There are a spread of Sr–In bond distances ranging from 3.34–3.94 Å. Pt is bonded in a 9-coordinate geometry to two equivalent Sr and seven In atoms. There are a spread of Pt–In bond distances ranging from 2.72–2.85 Å. There are three inequivalent In sites. In the first In site, In is bonded in a 3-coordinate geometry to three equivalent Sr, three equivalent Pt, and one In atom. The In–In bond length is 3.22 Å. In the second In site, In is bonded in a distorted q6 geometry to four equivalent Sr and six In atoms. All In–In bond lengths are 3.21 Å. In the third In site, In is bonded in a 2-coordinate geometry to three equivalent Sr, one Pt, and four equivalent In atoms.
DOI: 10.17188/1196399
title: Materials Data on EuB2Rh3 by Materials Project

description: EuRh3B2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Eu is bonded in a 12-coordinate geometry to two equivalent Eu, twelve equivalent Rh, and six equivalent B atoms. Both Eu–Eu bond lengths are 2.96 Å. All Eu–Rh bond lengths are 3.20 Å. All Eu–B bond lengths are 3.27 Å. Rh is bonded in a distorted square co-planar geometry to four equivalent Eu and four equivalent B atoms. All Rh–B bond lengths are 2.21 Å. B is bonded in a 6-coordinate geometry to three equivalent Eu and six equivalent Rh atoms.