cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1196046
title: Materials Data on Dy2Sn2O7 by Materials Project

description: Dy2Sn2O7 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Dy3+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are two shorter (2.27 Å) and six longer (2.51 Å) Dy–O bond lengths. Sn4+ is bonded to six equivalent O2- atoms to form corner-sharing SnO6 octahedra. The corner-sharing octahedral tilt angles are 54°. All Sn–O bond lengths are 2.08 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent Dy3+ atoms to form ODy4 tetrahedra that share corners with sixteen ODy4 tetrahedra and edges with six equivalent ODy2Sn2 tetrahedra. In the second O2- site, O2- is bonded to two equivalent Dy3+ and two equivalent Sn4+ atoms to form a mixture of distorted edge and corner-sharing ODy2Sn2 tetrahedra.
DOI: 10.17188/1196047
title: Materials Data on CaIn2Ir by Materials Project

description: CaIrIn2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Ca sites. In the first Ca site, Ca is bonded in a 1-coordinate geometry to three Ir and ten In atoms. There are a spread of Ca–Ir bond distances ranging from 2.98–3.18 Å. There are a spread of Ca–In bond distances ranging from 3.35–3.53 Å. In the second Ca site, Ca is bonded in a 2-coordinate geometry to three Ir and ten In atoms. There are a spread of Ca–Ir bond distances ranging from 3.07–3.25 Å. There are a spread of Ca–In bond distances ranging from 3.32–3.61 Å. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 9-coordinate geometry to three Ca and six In atoms. There are a spread of Ir–In bond distances ranging from 2.76–2.83 Å. In the second Ir site, Ir is bonded in a 9-coordinate geometry to three Ca and six In atoms. There are a spread of Ir–In bond distances ranging from 2.78–2.82 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 12-coordinate geometry to five Ca, three Ir, and four In atoms. There are a spread of In–In bond distances ranging from 3.12–3.28 Å. In the second In site, In is bonded in a 12-coordinate geometry to five Ca, three Ir, and four In atoms. There are one shorter (3.19 Å) and two longer (3.23 Å) In–In bond lengths.
DOI: 10.17188/1196048
title: Materials Data on TmIn by Materials Project

description: TmIn is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Tm is bonded in a body-centered cubic geometry to eight equivalent In atoms. All Tm–In bond lengths are 3.22 Å. In is bonded in a body-centered cubic geometry to eight equivalent Tm atoms.
DOI: 10.17188/1196049
title: Materials Data on Pd3Pb by Materials Project

description: Pd3Pb is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pd is bonded to eight equivalent Pd and four equivalent Pb atoms to form PdPd8Pb4 cuboctahedra that share corners with twelve equivalent PdPd8Pb4 cuboctahedra, edges with eight equivalent PbPd12 cuboctahedra, edges with sixteen equivalent PdPd8Pb4 cuboctahedra, faces with four equivalent PbPd12 cuboctahedra, and faces with fourteen equivalent PdPd8Pb4 cuboctahedra. All Pd–Pd bond lengths are 2.91 Å. All Pd–Pb bond lengths are 2.91 Å. Pb is bonded to twelve equivalent Pd atoms to form PbPd12 cuboctahedra that share corners with twelve equivalent PbPd12 cuboctahedra, edges with twenty-four equivalent PdPd8Pb4 cuboctahedra, faces with six equivalent PbPd12 cuboctahedra, and faces with twelve equivalent PdPd8Pb4 cuboctahedra.
DOI: 10.17188/1196050
title: Materials Data on PrCo2 by Materials Project

description: PrCo2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Pr is bonded in a 12-coordinate geometry to twelve equivalent Co atoms. All Pr–Co bond lengths are 3.04 Å. Co is bonded to six equivalent Pr and six equivalent Co atoms to form a mixture of edge, corner, and face-sharing CoPr6Co6 cuboctahedra. All Co–Co bond lengths are 2.59 Å.
DOI: 10.17188/1196051
title: Materials Data on Eu(Sb3Ru)4 by Materials Project

description: EuRu4Sb12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Eu2+ is bonded to twelve equivalent Sb1- atoms to form EuSb12 cuboctahedra that share faces with eight equivalent RuSb6 octahedra. All Eu–Sb bond lengths are 3.54 Å. Ru+2.50+ is bonded to six equivalent Sb1- atoms to form RuSb6 octahedra that share corners with six equivalent RuSb6 octahedra and faces with two equivalent EuSb12 cuboctahedra. The corner-sharing octahedral tilt angles are 55°. All Ru–Sb bond lengths are 2.65 Å. Sb1- is bonded in a 2-coordinate geometry to one Eu2+, two equivalent Ru+2.50+, and two equivalent Sb1- atoms. Both Sb–Sb bond lengths are 2.99 Å.
DOI: 10.17188/1196052
title: Materials Data on Eu(FeP3)4 by Materials Project

description: EuFe4P12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Eu2+ is bonded to twelve equivalent P1- atoms to form EuP12 cuboctahedra that share faces with eight equivalent FeP6 octahedra. All Eu–P bond lengths are 3.00 Å. Fe+2.50+ is bonded to six equivalent P1- atoms to form FeP6 octahedra that share corners with six equivalent FeP6 octahedra and faces with two equivalent EuP12 cuboctahedra. The corner-sharing octahedral tilt angles are 60°. All Fe–P bond lengths are 2.25 Å. P1- is bonded in a distorted bent 120 degrees geometry to one Eu2+, two equivalent Fe+2.50+, and two equivalent P1- atoms. There are one shorter (2.29 Å) and one longer (2.35 Å) P–P bond lengths.
DOI: 10.17188/1196053
title: Materials Data on CoB by Materials Project

description: CoB crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Co3+ is bonded in a 7-coordinate geometry to seven equivalent B3- atoms. There are a spread of Co–B bond distances ranging from 2.08–2.15 Å. B3- is bonded in a 9-coordinate geometry to seven equivalent Co3+ and two equivalent B3- atoms. Both B–B bond lengths are 1.84 Å.
DOI: 10.17188/1196054
title: Materials Data on DyCuSb2 by Materials Project

description: DyCuSb2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Dy3+ is bonded in a 8-coordinate geometry to eight Sb2- atoms. There are four shorter (3.18 Å) and four longer (3.26 Å) Dy–Sb bond lengths. Cu1+ is bonded to four equivalent Sb2- atoms to form a mixture of corner and edge-sharing CuSb4 tetrahedra. All Cu–Sb bond lengths are 2.68 Å. There are two inequivalent Sb2- sites. In the first Sb2- site, Sb2- is bonded in a 8-coordinate geometry to four equivalent Dy3+ and four equivalent Cu1+ atoms. In the second Sb2- site, Sb2- is bonded in a 8-coordinate geometry to four equivalent Dy3+ and four equivalent Sb2- atoms. All Sb–Sb bond lengths are 3.06 Å.
DOI: 10.17188/1196055
title: Materials Data on PuS by Materials Project

description: PuS is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pu is bonded to six equivalent S atoms to form a mixture of edge and corner-sharing PuS6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Pu–S bond lengths are 2.81 Å. S is bonded to six equivalent Pu atoms to form a mixture of edge and corner-sharing SPu6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196056
title: Materials Data on Mn3SnC by Materials Project

description: Mn3SnC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mn is bonded in a linear geometry to four equivalent Sn and two equivalent C atoms. All Mn–Sn bond lengths are 2.75 Å. Both Mn–C bond lengths are 1.95 Å. Sn is bonded to twelve equivalent Mn atoms to form SnMn12 cuboctahedra that share corners with twelve equivalent SnMn12 cuboctahedra, faces with six equivalent SnMn12 cuboctahedra, and faces with eight equivalent CMn6 octahedra. C is bonded to six equivalent Mn atoms to form CMn6 octahedra that share corners with six equivalent CMn6 octahedra and faces with eight equivalent SnMn12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1196057
title: Materials Data on CrGe by Materials Project

description: CrGe crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Cr is bonded in a 7-coordinate geometry to seven equivalent Ge atoms. There are a spread of Cr–Ge bond distances ranging from 2.41–2.66 Å. Ge is bonded in a 7-coordinate geometry to seven equivalent Cr atoms.
DOI: 10.17188/1196058
title: Materials Data on CoSe2 by Materials Project

description: CoSe2 is Marcasite structured and crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Co4+ is bonded to six equivalent Se2- atoms to form a mixture of corner and edge-sharing CoSe6 octahedra. The corner-sharing octahedral tilt angles are 57°. There are two shorter (2.40 Å) and four longer (2.41 Å) Co–Se bond lengths. Se2- is bonded in a 3-coordinate geometry to three equivalent Co4+ atoms.
DOI: 10.17188/1196059
title: Materials Data on Sb2Pt2O7 by Materials Project

description: Pt2Sb2O7 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Pt4+ is bonded to six equivalent O2- atoms to form corner-sharing PtO6 octahedra. The corner-sharing octahedral tilt angles are 52°. All Pt–O bond lengths are 2.04 Å. Sb3+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are two shorter (2.25 Å) and six longer (2.51 Å) Sb–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent Sb3+ atoms to form OSb4 tetrahedra that share corners with sixteen OSb4 tetrahedra and edges with six equivalent OSb2Pt2 tetrahedra. In the second O2- site, O2- is bonded to two equivalent Pt4+ and two equivalent Sb3+ atoms to form a mixture of distorted corner and edge-sharing OSb2Pt2 tetrahedra.
DOI: 10.17188/1196060
title: Materials Data on VNi2Sn by Materials Project

description: VNi2Sn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. V is bonded in a distorted body-centered cubic geometry to eight equivalent Ni and six equivalent Sn atoms. All V–Ni bond lengths are 2.61 Å. All V–Sn bond lengths are 3.02 Å. Ni is bonded in a body-centered cubic geometry to four equivalent V and four equivalent Sn atoms. All Ni–Sn bond lengths are 2.61 Å. Sn is bonded in a distorted body-centered cubic geometry to six equivalent V and eight equivalent Ni atoms.
DOI: 10.17188/1196061
title: Materials Data on YCuPb by Materials Project

description: YCuPb crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Y is bonded in a 12-coordinate geometry to six equivalent Cu and six equivalent Pb atoms. There are three shorter (2.98 Å) and three longer (3.59 Å) Y–Cu bond lengths. There are three shorter (3.17 Å) and three longer (3.34 Å) Y–Pb bond lengths. Cu is bonded in a 10-coordinate geometry to six equivalent Y and four equivalent Pb atoms. There are three shorter (2.76 Å) and one longer (3.00 Å) Cu–Pb bond lengths. Pb is bonded in a 10-coordinate geometry to six equivalent Y and four equivalent Cu atoms.
DOI: 10.17188/1196062
title: Materials Data on GeRh by Materials Project

description: RhGe crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Rh is bonded in a 4-coordinate geometry to seven equivalent Ge atoms. There are a spread of Rh–Ge bond distances ranging from 2.47–2.84 Å. Ge is bonded in a 7-coordinate geometry to seven equivalent Rh atoms.
DOI: 10.17188/1196065
title: Materials Data on Eu(AlGa)2 by Materials Project

description: EuAl2Ga2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Eu is bonded in a 8-coordinate geometry to eight equivalent Ga and eight equivalent Al atoms. All Eu–Ga bond lengths are 3.31 Å. All Eu–Al bond lengths are 3.50 Å. Ga is bonded in a 9-coordinate geometry to four equivalent Eu, one Ga, and four equivalent Al atoms. The Ga–Ga bond length is 2.51 Å. All Ga–Al bond lengths are 2.63 Å. Al is bonded to four equivalent Eu and four equivalent Ga atoms to form a mixture of distorted corner, edge, and face-sharing AlEu4Ga4 tetrahedra.
DOI: 10.17188/1196066
title: Materials Data on Fe2W by Materials Project

description: Fe2W is Hexagonal Laves structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. W is bonded in a 12-coordinate geometry to four equivalent W and twelve Fe atoms. There are one shorter (2.83 Å) and three longer (2.91 Å) W–W bond lengths. There are a spread of W–Fe bond distances ranging from 2.73–2.81 Å. There are two inequivalent Fe sites. In the first Fe site, Fe is bonded to six equivalent W and six equivalent Fe atoms to form a mixture of face, edge, and corner-sharing FeFe6W6 cuboctahedra. All Fe–Fe bond lengths are 2.39 Å. In the second Fe site, Fe is bonded to six equivalent W and six Fe atoms to form a mixture of face, edge, and corner-sharing FeFe6W6 cuboctahedra. There are two shorter (2.29 Å) and two longer (2.39 Å) Fe–Fe bond lengths.
DOI: 10.17188/1196067
title: Materials Data on GdTiGe by Materials Project

description: GdTiGe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Gd is bonded in a 5-coordinate geometry to five equivalent Ge atoms. There are four shorter (3.01 Å) and one longer (3.26 Å) Gd–Ge bond lengths. Ti is bonded in a 12-coordinate geometry to four equivalent Ge atoms. All Ti–Ge bond lengths are 2.74 Å. Ge is bonded in a 9-coordinate geometry to five equivalent Gd and four equivalent Ti atoms.
DOI: 10.17188/1196068
title: Materials Data on Dy2InPd2 by Materials Project

description: Dy2Pd2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Dy is bonded in a 6-coordinate geometry to six equivalent Pd and four equivalent In atoms. There are two shorter (2.86 Å) and four longer (3.01 Å) Dy–Pd bond lengths. All Dy–In bond lengths are 3.41 Å. Pd is bonded in a 9-coordinate geometry to six equivalent Dy, one Pd, and two equivalent In atoms. The Pd–Pd bond length is 2.80 Å. Both Pd–In bond lengths are 3.04 Å. In is bonded to eight equivalent Dy and four equivalent Pd atoms to form a mixture of corner and face-sharing InDy8Pd4 cuboctahedra.
DOI: 10.17188/1196069
title: Materials Data on Sr(AlPb)2 by Materials Project

description: Sr(AlPb)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sr is bonded in a body-centered cubic geometry to eight equivalent Pb atoms. All Sr–Pb bond lengths are 3.65 Å. Al is bonded to four equivalent Pb atoms to form a mixture of edge and corner-sharing AlPb4 tetrahedra. All Al–Pb bond lengths are 2.91 Å. Pb is bonded in a 9-coordinate geometry to four equivalent Sr and four equivalent Al atoms.
DOI: 10.17188/1196070
title: Materials Data on EuB6 by Materials Project

description: EuB6 is Calcium hexaboride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Eu is bonded in a 1-coordinate geometry to twenty-four equivalent B atoms. All Eu–B bond lengths are 3.07 Å. B is bonded in a 1-coordinate geometry to four equivalent Eu and five equivalent B atoms. There is one shorter (1.68 Å) and four longer (1.76 Å) B–B bond length.
DOI: 10.17188/1196071
title: Materials Data on TbInRh by Materials Project

description: TbRhIn crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Tb is bonded in a 11-coordinate geometry to five Rh and six equivalent In atoms. There are four shorter (3.03 Å) and one longer (3.07 Å) Tb–Rh bond lengths. There are two shorter (3.22 Å) and four longer (3.34 Å) Tb–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 Tb and three equivalent In atoms. All Rh–In bond lengths are 2.85 Å. In the second Rh site, Rh is bonded in a 9-coordinate geometry to three equivalent Tb and six equivalent In atoms. All Rh–In bond lengths are 2.77 Å. In is bonded in a 10-coordinate geometry to six equivalent Tb and four Rh atoms.
DOI: 10.17188/1196072
title: Materials Data on NbCoB2 by Materials Project

description: NbCoB2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Nb5+ is bonded in a 9-coordinate geometry to nine B3- atoms. There are a spread of Nb–B bond distances ranging from 2.42–2.55 Å. Co1+ is bonded in a 5-coordinate geometry to five B3- atoms. There are a spread of Co–B bond distances ranging from 2.00–2.12 Å. There are two inequivalent B3- sites. In the first B3- site, B3- is bonded in a 9-coordinate geometry to five equivalent Nb5+, two equivalent Co1+, and two equivalent B3- atoms. Both B–B bond lengths are 1.86 Å. In the second B3- site, B3- is bonded in a 9-coordinate geometry to four equivalent Nb5+, three equivalent Co1+, and two equivalent B3- atoms.
DOI: 10.17188/1196073
title: Materials Data on PbO by Materials Project

description: PbO is TlF-II structured and crystallizes in the orthorhombic Pbcm space group. The structure is two-dimensional and consists of one PbO sheet oriented in the (0, 0, 1) direction. Pb2+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent O2- atoms. There are a spread of Pb–O bond distances ranging from 2.26–2.51 Å. O2- is bonded in a distorted see-saw-like geometry to four equivalent Pb2+ atoms.
DOI: 10.17188/1196074
title: Materials Data on CaHgPb by Materials Project

description: CaHgPb is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ca is bonded to six equivalent Hg and six equivalent Pb atoms to form a mixture of edge and face-sharing CaHg6Pb6 cuboctahedra. All Ca–Hg bond lengths are 3.52 Å. All Ca–Pb bond lengths are 3.52 Å. Hg is bonded in a 9-coordinate geometry to six equivalent Ca and three equivalent Pb atoms. All Hg–Pb bond lengths are 2.97 Å. Pb is bonded in a 9-coordinate geometry to six equivalent Ca and three equivalent Hg atoms.
DOI: 10.17188/1196075
title: Materials Data on CeAl2 by Materials Project

description: CeAl2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to four equivalent Ce and twelve equivalent Al atoms. All Ce–Ce bond lengths are 3.44 Å. All Ce–Al bond lengths are 3.30 Å. Al is bonded to six equivalent Ce and six equivalent Al atoms to form a mixture of edge, corner, and face-sharing AlCe6Al6 cuboctahedra. All Al–Al bond lengths are 2.81 Å.
DOI: 10.17188/1196076
title: Materials Data on NdAgPb by Materials Project

description: NdAgPb crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to six equivalent Ag and six equivalent Pb atoms. There are three shorter (3.19 Å) and three longer (3.72 Å) Nd–Ag bond lengths. There are three shorter (3.31 Å) and three longer (3.57 Å) Nd–Pb bond lengths. Ag is bonded in a 10-coordinate geometry to six equivalent Nd and four equivalent Pb atoms. There are three shorter (2.92 Å) and one longer (3.17 Å) Ag–Pb bond lengths. Pb is bonded in a 10-coordinate geometry to six equivalent Nd and four equivalent Ag atoms.
DOI: 10.17188/1196077
title: Materials Data on LaNiBN by Materials Project

description: LaNiBN crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. La3+ is bonded to five equivalent N3- atoms to form a mixture of edge and corner-sharing LaN5 square pyramids. There are one shorter (2.53 Å) and four longer (2.67 Å) La–N bond lengths. Ni3+ is bonded to four equivalent B3- atoms to form distorted NiB4 tetrahedra that share corners with four equivalent NLa5B octahedra, corners with four equivalent NiB4 tetrahedra, and edges with four equivalent NiB4 tetrahedra. The corner-sharing octahedral tilt angles are 63°. All Ni–B bond lengths are 2.13 Å. B3- is bonded in a single-bond geometry to four equivalent Ni3+ and one N3- atom. The B–N bond length is 1.44 Å. N3- is bonded to five equivalent La3+ and one B3- atom to form distorted NLa5B octahedra that share corners with four equivalent NLa5B octahedra, corners with four equivalent NiB4 tetrahedra, and edges with eight equivalent NLa5B octahedra. The corner-sharing octahedral tilt angles are 3°.
DOI: 10.17188/1196078
title: Materials Data on CeBO3 by Materials Project

description: CeBO3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce3+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Ce–O bond distances ranging from 2.41–2.73 Å. B3+ is bonded in a trigonal planar geometry to three O2- atoms. All B–O bond lengths are 1.38 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent Ce3+ and one B3+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent Ce3+ and one B3+ atom.
DOI: 10.17188/1196079
title: Materials Data on Fe3Sn by Materials Project

description: Fe3Sn crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Fe sites. In the first Fe site, Fe is bonded to eight Fe and four equivalent Sn atoms to form distorted FeFe8Sn4 cuboctahedra that share corners with four equivalent SnFe12 cuboctahedra, corners with fourteen FeFe8Sn4 cuboctahedra, edges with six equivalent SnFe12 cuboctahedra, edges with twelve FeFe8Sn4 cuboctahedra, faces with four equivalent SnFe12 cuboctahedra, and faces with sixteen FeFe8Sn4 cuboctahedra. There are a spread of Fe–Fe bond distances ranging from 2.48–3.00 Å. There are two shorter (2.75 Å) and two longer (2.77 Å) Fe–Sn bond lengths. In the second Fe site, Fe is bonded to eight equivalent Fe and four equivalent Sn atoms to form distorted FeFe8Sn4 cuboctahedra that share corners with four equivalent SnFe12 cuboctahedra, corners with fourteen FeFe8Sn4 cuboctahedra, edges with six equivalent SnFe12 cuboctahedra, edges with twelve equivalent FeFe8Sn4 cuboctahedra, faces with four equivalent SnFe12 cuboctahedra, and faces with sixteen FeFe8Sn4 cuboctahedra. There are two shorter (2.75 Å) and two longer (2.77 Å) Fe–Sn bond lengths. Sn is bonded to twelve Fe atoms to form SnFe12 cuboctahedra that share corners with six equivalent SnFe12 cuboctahedra, corners with twelve FeFe8Sn4 cuboctahedra, edges with eighteen FeFe8Sn4 cuboctahedra, faces with eight equivalent SnFe12 cuboctahedra, and faces with twelve FeFe8Sn4 cuboctahedra.
DOI: 10.5281/zenodo.4477095
title: Connecting the Light Curves of Type IIP Supernovae to the Properties of their Progenitors

description: This is the dataset for the manuscript "Connecting the Light Curves of Type IIP Supernovae to the Properties of their Progenitors" (submitted to ApJ, arXiv link to follow).
DOI: 10.17188/1196080
title: Materials Data on Fe4P by Materials Project

description: Fe4P crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. there are two inequivalent Fe sites. In the first Fe site, Fe is bonded to twelve equivalent Fe atoms to form FeFe12 cuboctahedra that share corners with twelve equivalent FeFe12 cuboctahedra, faces with six equivalent FeFe12 cuboctahedra, and faces with eight equivalent PFe6 octahedra. All Fe–Fe bond lengths are 2.92 Å. In the second Fe site, Fe is bonded in a linear geometry to four equivalent Fe and two equivalent P atoms. Both Fe–P bond lengths are 2.07 Å. P is bonded to six equivalent Fe atoms to form PFe6 octahedra that share corners with six equivalent PFe6 octahedra and faces with eight equivalent FeFe12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.