cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1315451
title: Materials Data on K2PtC2 by Materials Project

description: K2PtC2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. K1+ is bonded in a 6-coordinate geometry to three equivalent Pt2- and three equivalent C atoms. All K–Pt bond lengths are 3.32 Å. All K–C bond lengths are 3.04 Å. Pt2- is bonded in a distorted linear geometry to six equivalent K1+ and two equivalent C atoms. Both Pt–C bond lengths are 1.98 Å. C is bonded in a linear geometry to three equivalent K1+, one Pt2-, and one C atom. The C–C bond length is 1.28 Å.
DOI: 10.17188/1315452
title: Materials Data on Ni3S by Materials Project

description: Ni3S is Uranium Silicide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ni is bonded to eight equivalent Ni and four equivalent S atoms to form distorted NiNi8S4 cuboctahedra that share corners with four equivalent SNi12 cuboctahedra, corners with fourteen equivalent NiNi8S4 cuboctahedra, edges with six equivalent SNi12 cuboctahedra, edges with twelve equivalent NiNi8S4 cuboctahedra, faces with four equivalent SNi12 cuboctahedra, and faces with sixteen equivalent NiNi8S4 cuboctahedra. There are a spread of Ni–Ni bond distances ranging from 2.49–2.55 Å. There are two shorter (2.49 Å) and two longer (2.54 Å) Ni–S bond lengths. S is bonded to twelve equivalent Ni atoms to form SNi12 cuboctahedra that share corners with six equivalent SNi12 cuboctahedra, corners with twelve equivalent NiNi8S4 cuboctahedra, edges with eighteen equivalent NiNi8S4 cuboctahedra, faces with eight equivalent SNi12 cuboctahedra, and faces with twelve equivalent NiNi8S4 cuboctahedra.
DOI: 10.17188/1315453
title: Materials Data on PrBiPd2 by Materials Project

description: PrPd2Bi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pr is bonded in a body-centered cubic geometry to eight equivalent Pd and six equivalent Bi atoms. All Pr–Pd bond lengths are 3.07 Å. All Pr–Bi bond lengths are 3.55 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Pr and four equivalent Bi atoms. All Pd–Bi bond lengths are 3.07 Å. Bi is bonded in a 8-coordinate geometry to six equivalent Pr and eight equivalent Pd atoms.
DOI: 10.17188/1315454
title: Materials Data on Li2Mg by Materials Project

description: MgLi2 crystallizes in the trigonal R32 space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to eight Li and four equivalent Mg atoms to form LiLi8Mg4 cuboctahedra that share corners with eighteen equivalent LiLi8Mg4 cuboctahedra, edges with eight equivalent MgLi9Mg3 cuboctahedra, edges with ten LiLi8Mg4 cuboctahedra, faces with eight equivalent MgLi9Mg3 cuboctahedra, and faces with twelve LiLi8Mg4 cuboctahedra. There are six shorter (3.07 Å) and two longer (3.08 Å) Li–Li bond lengths. All Li–Mg bond lengths are 3.08 Å. In the second Li site, Li is bonded to six equivalent Li and six equivalent Mg atoms to form LiLi6Mg6 cuboctahedra that share corners with six equivalent LiLi6Mg6 cuboctahedra, corners with twelve equivalent MgLi9Mg3 cuboctahedra, edges with eighteen LiLi8Mg4 cuboctahedra, faces with eight equivalent MgLi9Mg3 cuboctahedra, and faces with twelve equivalent LiLi8Mg4 cuboctahedra. All Li–Mg bond lengths are 3.07 Å. Mg is bonded to nine Li and three equivalent Mg atoms to form MgLi9Mg3 cuboctahedra that share corners with six equivalent LiLi6Mg6 cuboctahedra, corners with twelve equivalent MgLi9Mg3 cuboctahedra, edges with six equivalent MgLi9Mg3 cuboctahedra, edges with twelve equivalent LiLi8Mg4 cuboctahedra, faces with four equivalent MgLi9Mg3 cuboctahedra, and faces with sixteen LiLi8Mg4 cuboctahedra. All Mg–Mg bond lengths are 3.07 Å.
DOI: 10.17188/1315455
title: Materials Data on MgPb5 by Materials Project

description: MgPb5 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. Mg is bonded in a 10-coordinate geometry to ten Pb atoms. There are a spread of Mg–Pb bond distances ranging from 3.36–3.51 Å. There are five inequivalent Pb sites. In the first Pb site, Pb is bonded to twelve Pb atoms to form PbPb12 cuboctahedra that share corners with twelve PbPb12 cuboctahedra, edges with three equivalent PbMg4Pb8 cuboctahedra, and faces with six PbPb12 cuboctahedra. There are a spread of Pb–Pb bond distances ranging from 3.49–3.58 Å. In the second Pb site, Pb is bonded to four equivalent Mg and eight Pb atoms to form a mixture of distorted corner, edge, and face-sharing PbMg4Pb8 cuboctahedra. There are a spread of Pb–Pb bond distances ranging from 3.41–3.53 Å. In the third Pb site, Pb is bonded in a 12-coordinate geometry to two equivalent Mg and four Pb atoms. In the fourth Pb site, Pb is bonded in a 12-coordinate geometry to two equivalent Mg and six Pb atoms. In the fifth Pb site, Pb is bonded in a 12-coordinate geometry to two equivalent Mg and two equivalent Pb atoms.
DOI: 10.17188/1315456
title: Materials Data on Na(TeMo)3 by Materials Project

description: Na(MoTe)3 crystallizes in the hexagonal P6_3/m space group. The structure is three-dimensional. Na is bonded in a 9-coordinate geometry to nine equivalent Te atoms. There are six shorter (3.40 Å) and three longer (3.69 Å) Na–Te bond lengths. Mo is bonded in a 10-coordinate geometry to six equivalent Mo and four equivalent Te atoms. There are two shorter (2.67 Å) and four longer (2.78 Å) Mo–Mo bond lengths. There are a spread of Mo–Te bond distances ranging from 2.82–2.89 Å. Te is bonded in a 7-coordinate geometry to three equivalent Na and four equivalent Mo atoms.
DOI: 10.17188/1315457
title: Materials Data on Ni3Sb by Materials Project

description: Ni3Sb crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ni1+ is bonded in a see-saw-like geometry to four equivalent Sb3- atoms. There are two shorter (2.63 Å) and two longer (2.65 Å) Ni–Sb bond lengths. Sb3- is bonded to twelve equivalent Ni1+ atoms to form a mixture of corner and face-sharing SbNi12 cuboctahedra.
DOI: 10.17188/1315458
title: Materials Data on BaAs2Pt by Materials Project

description: BaPtAs2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ba2+ is bonded in a 10-coordinate geometry to ten As3- atoms. There are a spread of Ba–As bond distances ranging from 3.44–3.52 Å. Pt4+ is bonded in a 5-coordinate geometry to five As3- atoms. There are three shorter (2.58 Å) and two longer (2.61 Å) Pt–As bond lengths. There are two inequivalent As3- sites. In the first As3- site, As3- is bonded in a 9-coordinate geometry to six equivalent Ba2+, one Pt4+, and two equivalent As3- atoms. Both As–As bond lengths are 2.70 Å. In the second As3- site, As3- is bonded in a 8-coordinate geometry to four equivalent Ba2+ and four equivalent Pt4+ atoms.
DOI: 10.17188/1315459
title: Materials Data on NaNd3 by Materials Project

description: NaNd3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na is bonded to twelve equivalent Nd atoms to form NaNd12 cuboctahedra that share corners with twelve equivalent NaNd12 cuboctahedra, edges with twenty-four equivalent NdNa4Nd8 cuboctahedra, faces with six equivalent NaNd12 cuboctahedra, and faces with twelve equivalent NdNa4Nd8 cuboctahedra. All Na–Nd bond lengths are 3.66 Å. Nd is bonded to four equivalent Na and eight equivalent Nd atoms to form NdNa4Nd8 cuboctahedra that share corners with twelve equivalent NdNa4Nd8 cuboctahedra, edges with eight equivalent NaNd12 cuboctahedra, edges with sixteen equivalent NdNa4Nd8 cuboctahedra, faces with four equivalent NaNd12 cuboctahedra, and faces with fourteen equivalent NdNa4Nd8 cuboctahedra. All Nd–Nd bond lengths are 3.66 Å.
DOI: 10.17188/1315461
title: Materials Data on NaReO3 by Materials Project

description: NaReO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na1+ is bonded to twelve equivalent O2- atoms to form NaO12 cuboctahedra that share corners with twelve equivalent NaO12 cuboctahedra, faces with six equivalent NaO12 cuboctahedra, and faces with eight equivalent ReO6 octahedra. All Na–O bond lengths are 2.75 Å. Re5+ is bonded to six equivalent O2- atoms to form ReO6 octahedra that share corners with six equivalent ReO6 octahedra and faces with eight equivalent NaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Re–O bond lengths are 1.94 Å. O2- is bonded in a distorted linear geometry to four equivalent Na1+ and two equivalent Re5+ atoms.
DOI: 10.17188/1315463
title: Materials Data on Ni3As by Materials Project

description: Ni3As crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ni1+ is bonded in a see-saw-like geometry to four equivalent As3- atoms. There are two shorter (2.52 Å) and two longer (2.55 Å) Ni–As bond lengths. As3- is bonded to twelve equivalent Ni1+ atoms to form a mixture of corner and face-sharing AsNi12 cuboctahedra.
DOI: 10.17188/1315464
title: Materials Data on LuAlAg2 by Materials Project

description: LuAg2Al is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Lu is bonded in a body-centered cubic geometry to eight equivalent Ag atoms. All Lu–Ag bond lengths are 2.93 Å. Ag is bonded in a body-centered cubic geometry to four equivalent Lu and four equivalent Al atoms. All Ag–Al bond lengths are 2.93 Å. Al is bonded in a distorted body-centered cubic geometry to eight equivalent Ag atoms.
DOI: 10.17188/1315465
title: Materials Data on Ni3Hg by Materials Project

description: Ni3Hg 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 to eight Ni and four equivalent Hg atoms to form NiNi8Hg4 cuboctahedra that share corners with four equivalent HgNi12 cuboctahedra, corners with fourteen equivalent NiNi8Hg4 cuboctahedra, edges with six equivalent HgNi12 cuboctahedra, edges with twelve NiNi8Hg4 cuboctahedra, faces with four equivalent HgNi12 cuboctahedra, and faces with sixteen NiNi8Hg4 cuboctahedra. There are a spread of Ni–Ni bond distances ranging from 2.49–2.85 Å. There are two shorter (2.67 Å) and two longer (2.69 Å) Ni–Hg bond lengths. In the second Ni site, Ni is bonded to eight Ni and four equivalent Hg atoms to form NiNi8Hg4 cuboctahedra that share corners with four equivalent HgNi12 cuboctahedra, corners with fourteen NiNi8Hg4 cuboctahedra, edges with six equivalent HgNi12 cuboctahedra, edges with twelve NiNi8Hg4 cuboctahedra, faces with four equivalent HgNi12 cuboctahedra, and faces with sixteen NiNi8Hg4 cuboctahedra. There are one shorter (2.49 Å) and one longer (2.85 Å) Ni–Ni bond lengths. There are two shorter (2.67 Å) and two longer (2.69 Å) Ni–Hg bond lengths. Hg is bonded to twelve Ni atoms to form HgNi12 cuboctahedra that share corners with six equivalent HgNi12 cuboctahedra, corners with twelve NiNi8Hg4 cuboctahedra, edges with eighteen NiNi8Hg4 cuboctahedra, faces with eight equivalent HgNi12 cuboctahedra, and faces with twelve NiNi8Hg4 cuboctahedra.
DOI: 10.17188/1315466
title: Materials Data on Ho2OsPt by Materials Project

description: Ho2OsPt is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ho is bonded in a body-centered cubic geometry to four equivalent Os and four equivalent Pt atoms. All Ho–Os bond lengths are 2.98 Å. All Ho–Pt bond lengths are 2.98 Å. Os is bonded in a body-centered cubic geometry to eight equivalent Ho atoms. Pt is bonded in a body-centered cubic geometry to eight equivalent Ho atoms.
DOI: 10.17188/1315467
title: Materials Data on NaRe3 by Materials Project

description: NaRe3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a distorted body-centered cubic geometry to fourteen Re atoms. There are eight shorter (2.71 Å) and six longer (3.13 Å) Na–Re bond lengths. There are two inequivalent Re sites. In the first Re site, Re is bonded to four equivalent Na and four equivalent Re atoms to form a mixture of distorted edge, face, and corner-sharing ReNa4Re4 tetrahedra. All Re–Re bond lengths are 2.71 Å. In the second Re site, Re is bonded in a 8-coordinate geometry to six equivalent Na and eight equivalent Re atoms.
DOI: 10.17188/1315468
title: Materials Data on Li5Mg by Materials Project

description: Li5Mg crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are five inequivalent Li sites. In the first Li site, Li is bonded to ten Li and two equivalent Mg atoms to form distorted LiLi10Mg2 cuboctahedra that share corners with eighteen LiLi10Mg2 cuboctahedra, edges with six equivalent MgLi10Mg2 cuboctahedra, edges with twelve LiLi10Mg2 cuboctahedra, faces with three equivalent MgLi10Mg2 cuboctahedra, and faces with seventeen LiLi10Mg2 cuboctahedra. There are a spread of Li–Li bond distances ranging from 3.03–3.08 Å. Both Li–Mg bond lengths are 3.05 Å. In the second Li site, Li is bonded to ten Li and two equivalent Mg atoms to form distorted LiLi10Mg2 cuboctahedra that share corners with six equivalent MgLi10Mg2 cuboctahedra, corners with twelve LiLi10Mg2 cuboctahedra, edges with three equivalent MgLi10Mg2 cuboctahedra, edges with fifteen LiLi10Mg2 cuboctahedra, faces with three equivalent MgLi10Mg2 cuboctahedra, and faces with seventeen LiLi10Mg2 cuboctahedra. There are a spread of Li–Li bond distances ranging from 3.04–3.08 Å. Both Li–Mg bond lengths are 3.06 Å. In the third Li site, Li is bonded to eleven Li and one Mg atom to form distorted LiLi11Mg cuboctahedra that share corners with eighteen LiLi10Mg2 cuboctahedra, edges with four equivalent MgLi10Mg2 cuboctahedra, edges with fourteen LiLi10Mg2 cuboctahedra, faces with four equivalent MgLi10Mg2 cuboctahedra, and faces with sixteen LiLi10Mg2 cuboctahedra. There are a spread of Li–Li bond distances ranging from 3.05–3.08 Å. The Li–Mg bond length is 3.06 Å. In the fourth Li site, Li is bonded to ten Li and two equivalent Mg atoms to form LiLi10Mg2 cuboctahedra that share corners with six equivalent MgLi10Mg2 cuboctahedra, corners with twelve LiLi10Mg2 cuboctahedra, edges with three equivalent MgLi10Mg2 cuboctahedra, edges with fifteen LiLi10Mg2 cuboctahedra, faces with three equivalent MgLi10Mg2 cuboctahedra, and faces with seventeen LiLi10Mg2 cuboctahedra. There are two shorter (3.05 Å) and two longer (3.08 Å) Li–Li bond lengths. Both Li–Mg bond lengths are 3.07 Å. In the fifth Li site, Li is bonded to nine Li and three equivalent Mg atoms to form LiLi9Mg3 cuboctahedra that share corners with eighteen LiLi10Mg2 cuboctahedra, edges with two equivalent MgLi10Mg2 cuboctahedra, edges with sixteen LiLi10Mg2 cuboctahedra, faces with five equivalent MgLi10Mg2 cuboctahedra, and faces with fifteen LiLi10Mg2 cuboctahedra. Both Li–Li bond lengths are 3.08 Å. All Li–Mg bond lengths are 3.06 Å. Mg is bonded to ten Li and two equivalent Mg atoms to form MgLi10Mg2 cuboctahedra that share corners with six equivalent MgLi10Mg2 cuboctahedra, corners with twelve LiLi10Mg2 cuboctahedra, edges with eighteen LiLi10Mg2 cuboctahedra, faces with two equivalent MgLi10Mg2 cuboctahedra, and faces with eighteen LiLi10Mg2 cuboctahedra. Both Mg–Mg bond lengths are 3.08 Å.
DOI: 10.17188/1315469
title: Materials Data on Ni3H by Materials Project

description: Ni3H crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are three inequivalent Ni sites. In the first Ni site, Ni is bonded in a 2-coordinate geometry to eight Ni and two equivalent H atoms. There are a spread of Ni–Ni bond distances ranging from 2.33–2.64 Å. Both Ni–H bond lengths are 2.24 Å. In the second Ni site, Ni is bonded in a 2-coordinate geometry to eight Ni and two equivalent H atoms. There are three shorter (2.34 Å) and one longer (2.64 Å) Ni–Ni bond lengths. Both Ni–H bond lengths are 2.24 Å. In the third Ni site, Ni is bonded in a 2-coordinate geometry to eight Ni and two equivalent H atoms. Both Ni–H bond lengths are 2.23 Å. H is bonded in a 6-coordinate geometry to six Ni atoms.
DOI: 10.17188/1315470
title: Materials Data on Lu3In by Materials Project

description: Lu3In is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Lu is bonded to eight equivalent Lu and four equivalent In atoms to form distorted LuLu8In4 cuboctahedra that share corners with twelve equivalent LuLu8In4 cuboctahedra, edges with eight equivalent InLu12 cuboctahedra, edges with sixteen equivalent LuLu8In4 cuboctahedra, faces with four equivalent InLu12 cuboctahedra, and faces with fourteen equivalent LuLu8In4 cuboctahedra. All Lu–Lu bond lengths are 3.36 Å. All Lu–In bond lengths are 3.36 Å. In is bonded to twelve equivalent Lu atoms to form InLu12 cuboctahedra that share corners with twelve equivalent InLu12 cuboctahedra, edges with twenty-four equivalent LuLu8In4 cuboctahedra, faces with six equivalent InLu12 cuboctahedra, and faces with twelve equivalent LuLu8In4 cuboctahedra.
DOI: 10.17188/1315471
title: Materials Data on NaPuO3 by Materials Project

description: NaPuO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na1+ is bonded to twelve equivalent O2- atoms to form NaO12 cuboctahedra that share corners with twelve equivalent NaO12 cuboctahedra, faces with six equivalent NaO12 cuboctahedra, and faces with eight equivalent PuO6 octahedra. All Na–O bond lengths are 3.00 Å. Pu5+ is bonded to six equivalent O2- atoms to form PuO6 octahedra that share corners with six equivalent PuO6 octahedra and faces with eight equivalent NaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pu–O bond lengths are 2.12 Å. O2- is bonded in a distorted linear geometry to four equivalent Na1+ and two equivalent Pu5+ atoms.
DOI: 10.17188/1315472
title: Materials Data on Ni3Te by Materials Project

description: Ni3Te is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ni is bonded to eight equivalent Ni and four equivalent Te atoms to form NiNi8Te4 cuboctahedra that share corners with four equivalent TeNi12 cuboctahedra, corners with fourteen equivalent NiNi8Te4 cuboctahedra, edges with six equivalent TeNi12 cuboctahedra, edges with twelve equivalent NiNi8Te4 cuboctahedra, faces with four equivalent TeNi12 cuboctahedra, and faces with sixteen equivalent NiNi8Te4 cuboctahedra. There are a spread of Ni–Ni bond distances ranging from 2.58–2.76 Å. There are two shorter (2.66 Å) and two longer (2.67 Å) Ni–Te bond lengths. Te is bonded to twelve equivalent Ni atoms to form TeNi12 cuboctahedra that share corners with six equivalent TeNi12 cuboctahedra, corners with twelve equivalent NiNi8Te4 cuboctahedra, edges with eighteen equivalent NiNi8Te4 cuboctahedra, faces with eight equivalent TeNi12 cuboctahedra, and faces with twelve equivalent NiNi8Te4 cuboctahedra.
DOI: 10.17188/1315473
title: Materials Data on Li2RuF6 by Materials Project

description: Li2RuF6 is Hydrophilite-derived structured and crystallizes in the tetragonal P4_2/mnm space group. The structure is three-dimensional. Li1+ is bonded to six F1- atoms to form LiF6 octahedra that share corners with four equivalent LiF6 octahedra, corners with four equivalent RuF6 octahedra, an edgeedge with one LiF6 octahedra, and an edgeedge with one RuF6 octahedra. The corner-sharing octahedra tilt angles range from 47–53°. There are a spread of Li–F bond distances ranging from 2.04–2.10 Å. Ru4+ is bonded to six F1- atoms to form RuF6 octahedra that share corners with eight equivalent LiF6 octahedra and edges with two equivalent LiF6 octahedra. The corner-sharing octahedra tilt angles range from 47–48°. There is two shorter (1.92 Å) and four longer (1.98 Å) Ru–F bond length. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Li1+ and one Ru4+ atom. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Li1+ and one Ru4+ atom.
DOI: 10.17188/1315474
title: Materials Data on NaPdO3 by Materials Project

description: NaPdO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Na is bonded to twelve equivalent O atoms to form NaO12 cuboctahedra that share corners with twelve equivalent NaO12 cuboctahedra, faces with six equivalent NaO12 cuboctahedra, and faces with eight equivalent PdO6 octahedra. All Na–O bond lengths are 2.82 Å. Pd is bonded to six equivalent O atoms to form PdO6 octahedra that share corners with six equivalent PdO6 octahedra and faces with eight equivalent NaO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pd–O bond lengths are 2.00 Å. O is bonded to four equivalent Na and two equivalent Pd atoms to form a mixture of distorted face, edge, and corner-sharing ONa4Pd2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.
DOI: 10.17188/1315475
title: Materials Data on MgPb5 by Materials Project

description: MgPb5 crystallizes in the trigonal R32 space group. The structure is three-dimensional. Mg is bonded to twelve Pb atoms to form a mixture of corner and edge-sharing MgPb12 cuboctahedra. There are six shorter (3.46 Å) and six longer (3.54 Å) Mg–Pb bond lengths. There are five inequivalent Pb sites. In the first Pb site, Pb is bonded in a 12-coordinate geometry to two equivalent Mg and ten Pb atoms. There are a spread of Pb–Pb bond distances ranging from 3.45–3.56 Å. In the second Pb site, Pb is bonded in a 12-coordinate geometry to two equivalent Mg and ten Pb atoms. There are a spread of Pb–Pb bond distances ranging from 3.45–3.56 Å. In the third Pb site, Pb is bonded in a distorted trigonal planar geometry to three equivalent Mg and six Pb atoms. The Pb–Pb bond length is 3.53 Å. In the fourth Pb site, Pb is bonded in a 12-coordinate geometry to two equivalent Mg and ten Pb atoms. Both Pb–Mg bond lengths are 3.54 Å. There are a spread of Pb–Pb bond distances ranging from 3.45–3.56 Å. In the fifth Pb site, Pb is bonded in a 12-coordinate geometry to two equivalent Mg and ten Pb atoms.
DOI: 10.5281/zenodo.4482673
title: Climatic effects of flight reduction during the COVID-19 pandemic

description: Raw data, processed data, all scripts used for processing figures.
DOI: 10.17188/1315476
title: Materials Data on NaPd3 by Materials Project

description: NaPd3 is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Na is bonded to twelve Pd atoms to form a mixture of face, edge, and corner-sharing NaPd12 cuboctahedra. There are four shorter (2.84 Å) and eight longer (2.85 Å) Na–Pd bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded to four equivalent Na atoms to form a mixture of distorted edge and corner-sharing PdNa4 cuboctahedra. In the second Pd site, Pd is bonded in a distorted square co-planar geometry to four equivalent Na atoms.
DOI: 10.5281/zenodo.4482672
title: Climatic effects of flight reduction during the COVID-19 pandemic

description: Raw data, processed data, all scripts used for processing figures.
DOI: 10.17188/1315477
title: Materials Data on HoTmCu2 by Materials Project

description: TmHoCu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tm is bonded in a body-centered cubic geometry to eight equivalent Cu atoms. All Tm–Cu bond lengths are 2.97 Å. Ho is bonded in a body-centered cubic geometry to eight equivalent Cu atoms. All Ho–Cu bond lengths are 2.97 Å. Cu is bonded in a body-centered cubic geometry to four equivalent Tm and four equivalent Ho atoms.