cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.5281/zenodo.3755096
title: IODP Expedition 362 Thermal conductivity

description: Thermal conductivity was measured using the heated needle method in either full-space needle configuration (soft/saturated sediments) or half-space needle configuration (harder materials) of a TeKa Berlin TK-04 thermal conductivity meter. Heat is applied to the sample and then thermal equilibrium is sought. The heating and equilibration curve is reduced to derive the thermal conductivity value. Raw data are stored if a user wishes to do off-line or postexpedition reduction.
DOI: 10.17188/1188523
title: Materials Data on ErAl4Ge2Au by Materials Project

description: ErAuAl4Ge2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Er is bonded to six equivalent Ge atoms to form ErGe6 octahedra that share corners with twelve AlGe3Au tetrahedra, edges with six equivalent ErGe6 octahedra, and edges with six equivalent AlGe3Au tetrahedra. All Er–Ge bond lengths are 2.97 Å. Au is bonded in a body-centered cubic geometry to eight Al atoms. There are six shorter (2.58 Å) and two longer (2.60 Å) Au–Al bond lengths. There are two inequivalent Al sites. In the first Al site, Al is bonded to one Au and three equivalent Ge atoms to form AlGe3Au tetrahedra that share corners with three equivalent ErGe6 octahedra, corners with ten AlGe3Au tetrahedra, edges with three equivalent ErGe6 octahedra, and edges with three equivalent AlGeAu3 tetrahedra. The corner-sharing octahedral tilt angles are 15°. All Al–Ge bond lengths are 2.59 Å. In the second Al site, Al is bonded to three equivalent Au and one Ge atom to form distorted AlGeAu3 tetrahedra that share corners with three equivalent ErGe6 octahedra, corners with twelve AlGe3Au tetrahedra, and edges with six AlGe3Au tetrahedra. The corner-sharing octahedral tilt angles are 56°. The Al–Ge bond length is 2.65 Å. Ge is bonded to three equivalent Er and four Al atoms to form a mixture of distorted edge and corner-sharing GeEr3Al4 pentagonal bipyramids.
DOI: 10.17188/1188524
title: Materials Data on AgBF4 by Materials Project

description: AgBF4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ag1+ is bonded in a 10-coordinate geometry to ten F1- atoms. There are a spread of Ag–F bond distances ranging from 2.59–3.05 Å. B3+ is bonded in a tetrahedral geometry to four F1- atoms. There are a spread of B–F bond distances ranging from 1.40–1.43 Å. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Ag1+ and one B3+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to three equivalent Ag1+ and one B3+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to three equivalent Ag1+ and one B3+ atom.
DOI: 10.17188/1188525
title: Materials Data on HgB4O7 by Materials Project

description: HgB4O7 crystallizes in the orthorhombic Pmn2_1 space group. The structure is three-dimensional. Hg2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Hg–O bond distances ranging from 2.42–2.57 Å. There are two inequivalent B3+ sites. In the first B3+ site, B3+ is bonded to four O2- atoms to form corner-sharing BO4 tetrahedra. There are a spread of B–O bond distances ranging from 1.45–1.56 Å. In the second B3+ site, B3+ is bonded to four O2- atoms to form corner-sharing BO4 tetrahedra. There are a spread of B–O bond distances ranging from 1.43–1.55 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a bent 120 degrees geometry to one Hg2+ and two B3+ atoms. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Hg2+ and two B3+ atoms. In the third O2- site, O2- is bonded in a trigonal planar geometry to three B3+ atoms. In the fourth O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Hg2+ and two equivalent B3+ atoms.
DOI: 10.17188/1188526
title: Materials Data on MnCu2SiS4 by Materials Project

description: MnCu2SiS4 is Stannite-like structured and crystallizes in the orthorhombic Pmn2_1 space group. The structure is three-dimensional. Mn2+ is bonded to four S2- atoms to form MnS4 tetrahedra that share corners with four equivalent SiS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. There are a spread of Mn–S bond distances ranging from 2.39–2.43 Å. Cu1+ is bonded to four S2- atoms to form CuS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra, corners with four equivalent CuS4 tetrahedra, and corners with four equivalent SiS4 tetrahedra. There are a spread of Cu–S bond distances ranging from 2.30–2.33 Å. Si4+ is bonded to four S2- atoms to form SiS4 tetrahedra that share corners with four equivalent MnS4 tetrahedra and corners with eight equivalent CuS4 tetrahedra. There are one shorter (2.15 Å) and three longer (2.16 Å) Si–S bond lengths. There are three inequivalent S2- sites. In the first S2- site, S2- is bonded to one Mn2+, two equivalent Cu1+, and one Si4+ atom to form corner-sharing SMnCu2Si tetrahedra. In the second S2- site, S2- is bonded to one Mn2+, two equivalent Cu1+, and one Si4+ atom to form corner-sharing SMnCu2Si tetrahedra. In the third S2- site, S2- is bonded to one Mn2+, two equivalent Cu1+, and one Si4+ atom to form corner-sharing SMnCu2Si tetrahedra.
DOI: 10.17188/1188527
title: Materials Data on RbVSe2 by Materials Project

description: RbVSe2 crystallizes in the orthorhombic Fddd space group. The structure is three-dimensional. Rb1+ is bonded to eight equivalent Se2- atoms to form distorted RbSe8 hexagonal bipyramids that share corners with four equivalent RbSe8 hexagonal bipyramids, corners with six VSe4 tetrahedra, edges with six equivalent RbSe8 hexagonal bipyramids, edges with five VSe4 tetrahedra, and faces with two equivalent RbSe8 hexagonal bipyramids. There are a spread of Rb–Se bond distances ranging from 3.64–3.83 Å. There are two inequivalent V3+ sites. In the first V3+ site, V3+ is bonded to four equivalent Se2- atoms to form VSe4 tetrahedra that share corners with four equivalent RbSe8 hexagonal bipyramids, edges with six equivalent RbSe8 hexagonal bipyramids, and edges with two equivalent VSe4 tetrahedra. All V–Se bond lengths are 2.38 Å. In the second V3+ site, V3+ is bonded to four equivalent Se2- atoms to form VSe4 tetrahedra that share corners with eight equivalent RbSe8 hexagonal bipyramids, edges with four equivalent RbSe8 hexagonal bipyramids, and edges with two equivalent VSe4 tetrahedra. All V–Se bond lengths are 2.38 Å. Se2- is bonded in a 2-coordinate geometry to four equivalent Rb1+ and two V3+ atoms.
DOI: 10.17188/1188528
title: Materials Data on TaTlSe3 by Materials Project

description: TaTlSe3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ta5+ is bonded to six Se2- atoms to form distorted edge-sharing TaSe6 octahedra. There are a spread of Ta–Se bond distances ranging from 2.40–2.88 Å. Tl1+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of Tl–Se bond distances ranging from 3.19–3.74 Å. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a 4-coordinate geometry to three equivalent Ta5+ and one Tl1+ atom. In the second Se2- site, Se2- is bonded in a distorted single-bond geometry to one Ta5+ and four equivalent Tl1+ atoms. In the third Se2- site, Se2- is bonded in a 2-coordinate geometry to two equivalent Ta5+ and three equivalent Tl1+ atoms.
DOI: 10.17188/1188529
title: Materials Data on Li2CuP by Materials Project

description: Li2CuP crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Li1+ is bonded to four equivalent P3- atoms to form a mixture of distorted face, edge, and corner-sharing LiP4 tetrahedra. There are one shorter (2.58 Å) and three longer (2.65 Å) Li–P bond lengths. Cu1+ is bonded in a trigonal planar geometry to three equivalent P3- atoms. All Cu–P bond lengths are 2.33 Å. P3- is bonded in a 11-coordinate geometry to eight equivalent Li1+ and three equivalent Cu1+ atoms.
DOI: 10.17188/1188531
title: Materials Data on Gd2Mo2C3 by Materials Project

description: Gd2Mo2C3 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Gd3+ is bonded to five C4- atoms to form GdC5 square pyramids that share corners with two equivalent GdC5 square pyramids, corners with seven equivalent MoC4 tetrahedra, edges with five equivalent GdC5 square pyramids, and edges with three equivalent MoC4 tetrahedra. There are a spread of Gd–C bond distances ranging from 2.47–2.58 Å. Mo3+ is bonded to four C4- atoms to form distorted MoC4 tetrahedra that share corners with seven equivalent GdC5 square pyramids, corners with three equivalent MoC4 tetrahedra, edges with three equivalent GdC5 square pyramids, and edges with two equivalent MoC4 tetrahedra. There are a spread of Mo–C bond distances ranging from 2.07–2.17 Å. There are two inequivalent C4- sites. In the first C4- site, C4- is bonded to four equivalent Gd3+ and two equivalent Mo3+ atoms to form CGd4Mo2 octahedra that share corners with six equivalent CGd3Mo3 octahedra and edges with eight CGd4Mo2 octahedra. The corner-sharing octahedra tilt angles range from 11–29°. In the second C4- site, C4- is bonded to three equivalent Gd3+ and three equivalent Mo3+ atoms to form a mixture of edge and corner-sharing CGd3Mo3 octahedra. The corner-sharing octahedra tilt angles range from 11–29°.
DOI: 10.17188/1188532
title: Materials Data on DySbPd by Materials Project

description: DyPdSb crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. Dy is bonded in a 12-coordinate geometry to six equivalent Pd and six equivalent Sb atoms. There are three shorter (2.93 Å) and three longer (3.64 Å) Dy–Pd bond lengths. There are three shorter (3.15 Å) and three longer (3.34 Å) Dy–Sb bond lengths. Pd is bonded in a 10-coordinate geometry to six equivalent Dy and four equivalent Sb atoms. There are three shorter (2.78 Å) and one longer (2.91 Å) Pd–Sb bond lengths. Sb is bonded in a 10-coordinate geometry to six equivalent Dy and four equivalent Pd atoms.
DOI: 10.17188/1188533
title: Materials Data on Rb3Na(RuO4)2 by Materials Project

description: Rb3Na(RuO4)2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 1-coordinate geometry to ten O2- atoms. There are a spread of Rb–O bond distances ranging from 2.76–3.29 Å. In the second Rb1+ site, Rb1+ is bonded to twelve O2- atoms to form distorted RbO12 cuboctahedra that share edges with six equivalent RbO12 cuboctahedra, edges with six equivalent RuO4 tetrahedra, and faces with two equivalent NaO6 octahedra. There are six shorter (3.13 Å) and six longer (3.58 Å) Rb–O bond lengths. Na1+ is bonded to six equivalent O2- atoms to form NaO6 octahedra that share corners with six equivalent RuO4 tetrahedra and faces with two equivalent RbO12 cuboctahedra. All Na–O bond lengths are 2.46 Å. Ru6+ is bonded to four O2- atoms to form RuO4 tetrahedra that share corners with three equivalent NaO6 octahedra and edges with three equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 16°. There is one shorter (1.77 Å) and three longer (1.81 Å) Ru–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to four Rb1+, one Na1+, and one Ru6+ atom. In the second O2- site, O2- is bonded in a distorted linear geometry to four Rb1+ and one Ru6+ atom.
DOI: 10.17188/1188534
title: Materials Data on K3Na(RuO4)2 by Materials Project

description: K3Na(RuO4)2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a 1-coordinate geometry to ten O2- atoms. There are a spread of K–O bond distances ranging from 2.59–3.20 Å. In the second K1+ site, K1+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. All K–O bond lengths are 3.01 Å. Na1+ is bonded to six equivalent O2- atoms to form NaO6 octahedra that share corners with six equivalent RuO4 tetrahedra. All Na–O bond lengths are 2.40 Å. Ru6+ is bonded to four O2- atoms to form RuO4 tetrahedra that share corners with three equivalent NaO6 octahedra. The corner-sharing octahedral tilt angles are 16°. There is one shorter (1.77 Å) and three longer (1.81 Å) Ru–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to four K1+, one Na1+, and one Ru6+ atom. In the second O2- site, O2- is bonded in a linear geometry to one K1+ and one Ru6+ atom.
DOI: 10.5281/zenodo.3755673
title: IODP Expedition 362 Ion chromatography

description: Cation and anion concentration in interstitial water samples was measured by ion chromatography using a conductivity detector. Cation analytes include calcium, magnesium, potassium, and sodium. Anion analytes include chloride, sulfate, and bromide.
DOI: 10.17188/1188535
title: Materials Data on Nd2Sb by Materials Project

description: Nd2Sb crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded to five equivalent Sb atoms to form a mixture of distorted edge and corner-sharing NdSb5 square pyramids. There are one shorter (3.25 Å) and four longer (3.32 Å) Nd–Sb bond lengths. In the second Nd site, Nd is bonded in a 4-coordinate geometry to four equivalent Sb atoms. All Nd–Sb bond lengths are 3.36 Å. Sb is bonded in a 9-coordinate geometry to nine Nd atoms.
DOI: 10.5281/zenodo.3755672
title: IODP Expedition 362 Ion chromatography

description: Cation and anion concentration in interstitial water samples was measured by ion chromatography using a conductivity detector. Cation analytes include calcium, magnesium, potassium, and sodium. Anion analytes include chloride, sulfate, and bromide.
DOI: 10.17188/1188536
title: Materials Data on Er4Sb3 by Materials Project

description: Er4Sb3 crystallizes in the cubic I-43d space group. The structure is three-dimensional. Er is bonded in a 6-coordinate geometry to six equivalent Sb atoms. There are three shorter (3.05 Å) and three longer (3.28 Å) Er–Sb bond lengths. Sb is bonded to eight equivalent Er atoms to form a mixture of distorted face, edge, and corner-sharing SbEr8 hexagonal bipyramids.
DOI: 10.17188/1188537
title: Materials Data on Cr2B3 by Materials Project

description: Cr2B3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Cr+4.50+ sites. In the first Cr+4.50+ site, Cr+4.50+ is bonded to twelve B3- atoms to form a mixture of edge and face-sharing CrB12 cuboctahedra. There are a spread of Cr–B bond distances ranging from 2.25–2.34 Å. In the second Cr+4.50+ site, Cr+4.50+ is bonded in a 7-coordinate geometry to seven B3- atoms. There are a spread of Cr–B bond distances ranging from 2.12–2.26 Å. There are three inequivalent B3- sites. In the first B3- site, B3- is bonded in a 9-coordinate geometry to six equivalent Cr+4.50+ and three B3- atoms. There is two shorter (1.71 Å) and one longer (1.73 Å) B–B bond length. In the second B3- site, B3- is bonded in a 9-coordinate geometry to six Cr+4.50+ and three B3- atoms. Both B–B bond lengths are 1.77 Å. In the third B3- site, B3- is bonded in a 9-coordinate geometry to seven Cr+4.50+ and two equivalent B3- atoms.
DOI: 10.17188/1188538
title: Materials Data on LaCd2 by Materials Project

description: LaCd2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. La is bonded to twelve equivalent Cd atoms to form a mixture of distorted edge and face-sharing LaCd12 cuboctahedra. All La–Cd bond lengths are 3.47 Å. Cd is bonded in a 9-coordinate geometry to six equivalent La and three equivalent Cd atoms. All Cd–Cd bond lengths are 2.98 Å.
DOI: 10.17188/1188539
title: Materials Data on Ba(POs)2 by Materials Project

description: Ba(OsP)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ba2+ is bonded in a 8-coordinate geometry to eight equivalent Os2- atoms. All Ba–Os bond lengths are 3.69 Å. Os2- is bonded to four equivalent Ba2+ and four equivalent P1+ atoms to form a mixture of distorted corner, edge, and face-sharing OsBa4P4 tetrahedra. All Os–P bond lengths are 2.35 Å. P1+ is bonded in a 4-coordinate geometry to four equivalent Os2- atoms.
DOI: 10.17188/1188540
title: Materials Data on Er(PRu)2 by Materials Project

description: ErRu2P2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Er is bonded in a 8-coordinate geometry to eight equivalent Ru and eight equivalent P atoms. All Er–Ru bond lengths are 3.12 Å. All Er–P bond lengths are 3.10 Å. Ru is bonded in a 12-coordinate geometry to four equivalent Er and four equivalent P atoms. All Ru–P bond lengths are 2.35 Å. P is bonded in a 9-coordinate geometry to four equivalent Er, four equivalent Ru, and one P atom. The P–P bond length is 2.36 Å.
DOI: 10.17188/1188541
title: Materials Data on Sm(PRu)2 by Materials Project

description: Sm(RuP)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sm2+ is bonded in a distorted body-centered cubic geometry to eight equivalent P3- atoms. All Sm–P bond lengths are 3.14 Å. Ru2+ is bonded to four equivalent P3- atoms to form a mixture of edge and corner-sharing RuP4 tetrahedra. All Ru–P bond lengths are 2.36 Å. P3- is bonded in a 9-coordinate geometry to four equivalent Sm2+, four equivalent Ru2+, and one P3- atom. The P–P bond length is 2.51 Å.
DOI: 10.17188/1188542
title: Materials Data on Nd(AsPd)2 by Materials Project

description: Nd(PdAs)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Nd2+ is bonded in a distorted body-centered cubic geometry to eight equivalent As3- atoms. All Nd–As bond lengths are 3.29 Å. Pd2+ is bonded to four equivalent As3- atoms to form a mixture of edge and corner-sharing PdAs4 tetrahedra. All Pd–As bond lengths are 2.55 Å. As3- is bonded in a 9-coordinate geometry to four equivalent Nd2+, four equivalent Pd2+, and one As3- atom. The As–As bond length is 2.52 Å.
DOI: 10.17188/1188543
title: Materials Data on Lu(FeB)2 by Materials Project

description: Lu(FeB)2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Lu is bonded in a 8-coordinate geometry to eight equivalent Fe and eight equivalent B atoms. All Lu–Fe bond lengths are 2.89 Å. All Lu–B bond lengths are 2.66 Å. Fe is bonded to four equivalent Lu and four equivalent B atoms to form a mixture of distorted face, edge, and corner-sharing FeLu4B4 tetrahedra. All Fe–B bond lengths are 2.16 Å. B is bonded in a 9-coordinate geometry to four equivalent Lu, four equivalent Fe, and one B atom. The B–B bond length is 2.05 Å.
DOI: 10.17188/1188544
title: Materials Data on AgB2 by Materials Project

description: AgB2 is hexagonal omega structure structured and crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Ag is bonded to six equivalent Ag and twelve equivalent B atoms to form a mixture of distorted face, edge, and corner-sharing AgAg6B12 cuboctahedra. All Ag–Ag bond lengths are 3.03 Å. All Ag–B bond lengths are 2.68 Å. B is bonded in a distorted trigonal planar geometry to six equivalent Ag and three equivalent B atoms. All B–B bond lengths are 1.75 Å.
DOI: 10.17188/1188545
title: Materials Data on Ce(AgGe)2 by Materials Project

description: CeAg2Ge2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ce is bonded in a 8-coordinate geometry to eight equivalent Ag and eight equivalent Ge atoms. All Ce–Ag bond lengths are 3.53 Å. All Ce–Ge bond lengths are 3.28 Å. Ag is bonded to four equivalent Ce, four equivalent Ag, and four equivalent Ge atoms to form a mixture of distorted face, edge, and corner-sharing AgCe4Ag4Ge4 cuboctahedra. All Ag–Ag bond lengths are 3.04 Å. All Ag–Ge bond lengths are 2.67 Å. Ge is bonded in a 9-coordinate geometry to four equivalent Ce, four equivalent Ag, and one Ge atom. The Ge–Ge bond length is 2.45 Å.
DOI: 10.17188/1188546
title: Materials Data on Ag3Pt by Materials Project

description: PtAg3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pt is bonded to twelve equivalent Ag atoms to form PtAg12 cuboctahedra that share corners with twelve equivalent PtAg12 cuboctahedra, edges with twenty-four equivalent AgAg8Pt4 cuboctahedra, faces with six equivalent PtAg12 cuboctahedra, and faces with twelve equivalent AgAg8Pt4 cuboctahedra. All Pt–Ag bond lengths are 2.90 Å. Ag is bonded to four equivalent Pt and eight equivalent Ag atoms to form AgAg8Pt4 cuboctahedra that share corners with twelve equivalent AgAg8Pt4 cuboctahedra, edges with eight equivalent PtAg12 cuboctahedra, edges with sixteen equivalent AgAg8Pt4 cuboctahedra, faces with four equivalent PtAg12 cuboctahedra, and faces with fourteen equivalent AgAg8Pt4 cuboctahedra. All Ag–Ag bond lengths are 2.90 Å.
DOI: 10.17188/1188547
title: Materials Data on MnAl by Materials Project

description: MnAl is Tetraauricupride structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mn is bonded in a body-centered cubic geometry to eight equivalent Al atoms. All Mn–Al bond lengths are 2.55 Å. Al is bonded in a body-centered cubic geometry to eight equivalent Mn atoms.
DOI: 10.17188/1188548
title: Materials Data on NdFe2 by Materials Project

description: NdFe2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to twelve equivalent Fe atoms. All Nd–Fe bond lengths are 3.09 Å. Fe is bonded to six equivalent Nd and six equivalent Fe atoms to form a mixture of edge, face, and corner-sharing FeNd6Fe6 cuboctahedra. All Fe–Fe bond lengths are 2.63 Å.
DOI: 10.5281/zenodo.3755697
title: IODP Expedition 362 Towed magnetometer

description: Seafloor magnetometer data were measured using a Marine Magnetics 1000 m SeaSpy towed magnetometer. Raw log and data files are presented by expedition.
DOI: 10.5281/zenodo.3755696
title: IODP Expedition 362 Towed magnetometer

description: Seafloor magnetometer data were measured using a Marine Magnetics 1000 m SeaSpy towed magnetometer. Raw log and data files are presented by expedition.
DOI: 10.17188/1188549
title: Materials Data on CuAs by Materials Project

description: CuAs crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Cu1+ is bonded in a 6-coordinate geometry to six equivalent As1- atoms. All Cu–As bond lengths are 2.56 Å. As1- is bonded in a 6-coordinate geometry to six equivalent Cu1+ atoms.
DOI: 10.17188/1188550
title: Materials Data on Ti3As by Materials Project

description: Ti3As crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Ti is bonded in a 6-coordinate geometry to two equivalent Ti and four equivalent As atoms. Both Ti–Ti bond lengths are 2.51 Å. All Ti–As bond lengths are 2.81 Å. As is bonded to twelve equivalent Ti atoms to form a mixture of face and edge-sharing AsTi12 cuboctahedra.
DOI: 10.17188/1188551
title: Materials Data on UAu2 by Materials Project

description: UAu2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. U is bonded in a 12-coordinate geometry to two equivalent U and twelve equivalent Au atoms. Both U–U bond lengths are 3.02 Å. All U–Au bond lengths are 3.20 Å. Au is bonded in a 11-coordinate geometry to six equivalent U and five equivalent Au atoms. There are three shorter (2.82 Å) and two longer (3.02 Å) Au–Au bond lengths.