cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1195328
title: Materials Data on SrMnGe by Materials Project

description: SrMnGe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Sr is bonded in a 9-coordinate geometry to four equivalent Mn and five equivalent Ge atoms. All Sr–Mn bond lengths are 3.27 Å. There are four shorter (3.33 Å) and one longer (3.60 Å) Sr–Ge bond lengths. Mn is bonded in a 4-coordinate geometry to four equivalent Sr and four equivalent Ge atoms. All Mn–Ge bond lengths are 2.61 Å. Ge is bonded in a 9-coordinate geometry to five equivalent Sr and four equivalent Mn atoms.
DOI: 10.17188/1195329
title: Materials Data on LaRu2 by Materials Project

description: LaRu2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. La is bonded in a 12-coordinate geometry to twelve equivalent Ru atoms. All La–Ru bond lengths are 3.20 Å. Ru is bonded to six equivalent La and six equivalent Ru atoms to form a mixture of face, edge, and corner-sharing RuLa6Ru6 cuboctahedra. All Ru–Ru bond lengths are 2.73 Å.
DOI: 10.17188/1195330
title: Materials Data on LaZnSn by Materials Project

description: LaZnSn crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent La sites. In the first La site, La is bonded in a 12-coordinate geometry to six equivalent Zn and six equivalent Sn atoms. All La–Zn bond lengths are 3.13 Å. All La–Sn bond lengths are 3.52 Å. In the second La site, La is bonded to six equivalent Sn atoms to form distorted edge-sharing LaSn6 octahedra. All La–Sn bond lengths are 3.34 Å. Zn is bonded in a 6-coordinate geometry to three equivalent La and three equivalent Sn atoms. All Zn–Sn bond lengths are 2.75 Å. Sn is bonded in a 6-coordinate geometry to six La and three equivalent Zn atoms.
DOI: 10.17188/1195331
title: Materials Data on Si3Ru2 by Materials Project

description: Ru2Si3 is Magnesium tetraboride-like structured and crystallizes in the tetragonal P-4c2 space group. The structure is three-dimensional. there are three inequivalent Ru2+ sites. In the first Ru2+ site, Ru2+ is bonded in a 8-coordinate geometry to eight Si+1.33- atoms. There are four shorter (2.44 Å) and four longer (2.61 Å) Ru–Si bond lengths. In the second Ru2+ site, Ru2+ is bonded in a 6-coordinate geometry to six Si+1.33- atoms. There are four shorter (2.32 Å) and two longer (2.61 Å) Ru–Si bond lengths. In the third Ru2+ site, Ru2+ is bonded in a 6-coordinate geometry to eight Si+1.33- atoms. There are a spread of Ru–Si bond distances ranging from 2.35–2.89 Å. There are two inequivalent Si+1.33- sites. In the first Si+1.33- site, Si+1.33- is bonded in a 2-coordinate geometry to five Ru2+ atoms. In the second Si+1.33- site, Si+1.33- is bonded in a 4-coordinate geometry to five Ru2+ atoms.
DOI: 10.17188/1195332
title: Materials Data on HfMnSi by Materials Project

description: HfMnSi crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Hf is bonded in a 5-coordinate geometry to five equivalent Si atoms. There are a spread of Hf–Si bond distances ranging from 2.70–2.80 Å. Mn is bonded in a 4-coordinate geometry to four equivalent Si atoms. There are a spread of Mn–Si bond distances ranging from 2.39–2.51 Å. Si is bonded in a 9-coordinate geometry to five equivalent Hf and four equivalent Mn atoms.
DOI: 10.17188/1195333
title: Materials Data on DyCo3B2 by Materials Project

description: DyCo3B2 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Dy3+ is bonded in a hexagonal planar geometry to six equivalent B3- atoms. All Dy–B bond lengths are 2.88 Å. Co1+ is bonded in a square co-planar geometry to four equivalent B3- atoms. All Co–B bond lengths are 2.09 Å. B3- is bonded in a 6-coordinate geometry to three equivalent Dy3+ and six equivalent Co1+ atoms.
DOI: 10.17188/1195335
title: Materials Data on LaMnGe by Materials Project

description: LaMnGe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. La is bonded in a 9-coordinate geometry to four equivalent Mn and five equivalent Ge atoms. All La–Mn bond lengths are 3.17 Å. There are four shorter (3.22 Å) and one longer (3.38 Å) La–Ge bond lengths. Mn is bonded to four equivalent La and four equivalent Ge atoms to form a mixture of distorted face and edge-sharing MnLa4Ge4 tetrahedra. All Mn–Ge bond lengths are 2.61 Å. Ge is bonded in a 9-coordinate geometry to five equivalent La and four equivalent Mn atoms.
DOI: 10.17188/1195336
title: Materials Data on NbTe4 by Materials Project

description: NbTe4 crystallizes in the tetragonal P4/mcc space group. The structure is one-dimensional and consists of one NbTe4 ribbon oriented in the (0, 0, 1) direction. Nb2+ is bonded in a 8-coordinate geometry to eight equivalent Te+0.50- atoms. All Nb–Te bond lengths are 2.91 Å. Te+0.50- is bonded in a 3-coordinate geometry to two equivalent Nb2+ atoms.
DOI: 10.17188/1195337
title: Materials Data on Cr2GaC by Materials Project

description: Cr2GaC is H-Phase structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Cr is bonded in a 3-coordinate geometry to three equivalent Ga and three equivalent C atoms. All Cr–Ga bond lengths are 2.65 Å. All Cr–C bond lengths are 1.97 Å. Ga is bonded to six equivalent Cr and six equivalent Ga atoms to form distorted GaCr6Ga6 cuboctahedra that share corners with six equivalent GaCr6Ga6 cuboctahedra, corners with six equivalent CCr6 octahedra, edges with six equivalent GaCr6Ga6 cuboctahedra, edges with six equivalent CCr6 octahedra, and faces with six equivalent GaCr6Ga6 cuboctahedra. The corner-sharing octahedral tilt angles are 19°. All Ga–Ga bond lengths are 2.87 Å. C is bonded to six equivalent Cr atoms to form CCr6 octahedra that share corners with six equivalent GaCr6Ga6 cuboctahedra, edges with six equivalent GaCr6Ga6 cuboctahedra, and edges with six equivalent CCr6 octahedra.
DOI: 10.17188/1195338
title: Materials Data on CaIrO3 by Materials Project

description: CaIrO3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ca2+ is bonded in a 6-coordinate geometry to eight O2- atoms. There are a spread of Ca–O bond distances ranging from 2.40–2.75 Å. Ir4+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are four shorter (2.10 Å) and four longer (2.34 Å) Ir–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 5-coordinate geometry to three equivalent Ca2+ and two equivalent Ir4+ atoms. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Ca2+ and four equivalent Ir4+ atoms.
DOI: 10.17188/1195339
title: Materials Data on PPbS3 by Materials Project

description: PbPS3 crystallizes in the monoclinic Pc space group. The structure is three-dimensional. there are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Pb–S bond distances ranging from 3.03–3.25 Å. In the second Pb2+ site, Pb2+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Pb–S bond distances ranging from 3.03–3.28 Å. There are two inequivalent P4+ sites. In the first P4+ site, P4+ is bonded in a trigonal non-coplanar geometry to three S2- atoms. There are one shorter (2.03 Å) and two longer (2.04 Å) P–S bond lengths. In the second P4+ site, P4+ is bonded in a trigonal non-coplanar geometry to three S2- atoms. There are one shorter (2.03 Å) and two longer (2.04 Å) P–S bond lengths. There are six inequivalent S2- sites. In the first S2- site, S2- is bonded in a distorted single-bond geometry to three Pb2+ and one P4+ atom. In the second S2- site, S2- is bonded in a distorted single-bond geometry to three Pb2+ and one P4+ atom. In the third S2- site, S2- is bonded in a distorted single-bond geometry to three Pb2+ and one P4+ atom. In the fourth S2- site, S2- is bonded in a distorted single-bond geometry to two Pb2+ and one P4+ atom. In the fifth S2- site, S2- is bonded in a distorted single-bond geometry to three Pb2+ and one P4+ atom. In the sixth S2- site, S2- is bonded in a distorted single-bond geometry to two Pb2+ and one P4+ atom.
DOI: 10.17188/1195340
title: Materials Data on TaTe4 by Materials Project

description: TaTe4 crystallizes in the tetragonal P4/ncc space group. The structure is one-dimensional and consists of two TaTe4 ribbons oriented in the (0, 0, 1) direction. there are three inequivalent Ta5+ sites. In the first Ta5+ site, Ta5+ is bonded in a 8-coordinate geometry to eight Te+1.25- atoms. There are four shorter (2.82 Å) and four longer (2.99 Å) Ta–Te bond lengths. In the second Ta5+ site, Ta5+ is bonded in a 8-coordinate geometry to eight Te+1.25- atoms. There are four shorter (2.83 Å) and four longer (2.99 Å) Ta–Te bond lengths. In the third Ta5+ site, Ta5+ is bonded in a 8-coordinate geometry to eight Te+1.25- atoms. There are four shorter (2.92 Å) and four longer (2.93 Å) Ta–Te bond lengths. There are three inequivalent Te+1.25- sites. In the first Te+1.25- site, Te+1.25- is bonded in a 2-coordinate geometry to two Ta5+ atoms. In the second Te+1.25- site, Te+1.25- is bonded in a 3-coordinate geometry to two Ta5+ atoms. In the third Te+1.25- site, Te+1.25- is bonded in a 3-coordinate geometry to two Ta5+ atoms.
DOI: 10.17188/1195341
title: Materials Data on NdZnSn by Materials Project

description: NdZnSn crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded to six equivalent Sn atoms to form distorted edge-sharing NdSn6 octahedra. All Nd–Sn bond lengths are 3.26 Å. In the second Nd site, Nd is bonded in a 12-coordinate geometry to six equivalent Zn and six equivalent Sn atoms. All Nd–Zn bond lengths are 3.06 Å. All Nd–Sn bond lengths are 3.46 Å. Zn is bonded in a 6-coordinate geometry to three equivalent Nd and three equivalent Sn atoms. All Zn–Sn bond lengths are 2.74 Å. Sn is bonded in a 6-coordinate geometry to six Nd and three equivalent Zn atoms.
DOI: 10.17188/1195342
title: Materials Data on MgSn4Ru by Materials Project

description: MgRuSn4 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Mg is bonded in a distorted q6 geometry to two equivalent Ru and eight equivalent Sn atoms. Both Mg–Ru bond lengths are 2.85 Å. All Mg–Sn bond lengths are 3.04 Å. Ru is bonded in a 10-coordinate geometry to two equivalent Mg and eight equivalent Sn atoms. All Ru–Sn bond lengths are 2.88 Å. Sn is bonded in a 9-coordinate geometry to two equivalent Mg and two equivalent Ru atoms.
DOI: 10.17188/1195343
title: Materials Data on MnCuP by Materials Project

description: MnCuP crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Mn2+ is bonded in a 5-coordinate geometry to five equivalent P3- atoms. There are a spread of Mn–P bond distances ranging from 2.42–2.65 Å. Cu1+ is bonded to four equivalent P3- atoms to form a mixture of distorted edge and corner-sharing CuP4 tetrahedra. There are one shorter (2.28 Å) and three longer (2.37 Å) Cu–P bond lengths. P3- is bonded in a 9-coordinate geometry to five equivalent Mn2+ and four equivalent Cu1+ atoms.
DOI: 10.17188/1195344
title: Materials Data on Yb2Cu2O5 by Materials Project

description: Yb2Cu2O5 crystallizes in the orthorhombic Pna2_1 space group. The structure is three-dimensional. there are two inequivalent Yb3+ sites. In the first Yb3+ site, Yb3+ is bonded to six O2- atoms to form a mixture of distorted corner and edge-sharing YbO6 pentagonal pyramids. The corner-sharing octahedra tilt angles range from 31–76°. There are a spread of Yb–O bond distances ranging from 2.26–2.45 Å. In the second Yb3+ site, Yb3+ is bonded to six O2- atoms to form a mixture of corner and edge-sharing YbO6 octahedra. There are a spread of Yb–O bond distances ranging from 2.24–2.44 Å. There are two inequivalent Cu2+ sites. In the first Cu2+ site, Cu2+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Cu–O bond distances ranging from 1.83–1.89 Å. In the second Cu2+ site, Cu2+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Cu–O bond distances ranging from 1.84–1.88 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded to three Yb3+ and one Cu2+ atom to form distorted OYb3Cu tetrahedra that share corners with six OYb3Cu tetrahedra, corners with six OYb2Cu2 trigonal pyramids, and an edgeedge with one OYb2Cu2 trigonal pyramid. In the second O2- site, O2- is bonded to three Yb3+ and one Cu2+ atom to form distorted OYb3Cu tetrahedra that share corners with six OYb3Cu tetrahedra, corners with six OYb2Cu2 trigonal pyramids, and an edgeedge with one OYb2Cu2 trigonal pyramid. In the third O2- site, O2- is bonded to two equivalent Yb3+ and two Cu2+ atoms to form distorted OYb2Cu2 trigonal pyramids that share corners with six OYb3Cu tetrahedra, corners with two equivalent OYb2Cu2 trigonal pyramids, an edgeedge with one OYb3Cu tetrahedra, and an edgeedge with one OYb2Cu2 trigonal pyramid. In the fourth O2- site, O2- is bonded in a 4-coordinate geometry to two Yb3+ and two Cu2+ atoms. In the fifth O2- site, O2- is bonded to two equivalent Yb3+ and two Cu2+ atoms to form distorted OYb2Cu2 trigonal pyramids that share corners with six OYb3Cu tetrahedra, corners with two equivalent OYb2Cu2 trigonal pyramids, an edgeedge with one OYb3Cu tetrahedra, and an edgeedge with one OYb2Cu2 trigonal pyramid.
DOI: 10.17188/1195345
title: Materials Data on ThIn3 by Materials Project

description: ThIn3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Th is bonded to twelve equivalent In atoms to form ThIn12 cuboctahedra that share corners with twelve equivalent ThIn12 cuboctahedra, edges with twenty-four equivalent InTh4In8 cuboctahedra, faces with six equivalent ThIn12 cuboctahedra, and faces with twelve equivalent InTh4In8 cuboctahedra. All Th–In bond lengths are 3.36 Å. In is bonded to four equivalent Th and eight equivalent In atoms to form distorted InTh4In8 cuboctahedra that share corners with twelve equivalent InTh4In8 cuboctahedra, edges with eight equivalent ThIn12 cuboctahedra, edges with sixteen equivalent InTh4In8 cuboctahedra, faces with four equivalent ThIn12 cuboctahedra, and faces with fourteen equivalent InTh4In8 cuboctahedra. All In–In bond lengths are 3.36 Å.
DOI: 10.17188/1195346
title: Materials Data on MnAsRh by Materials Project

description: MnRhAs crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Mn is bonded in a 10-coordinate geometry to six equivalent Rh and four As atoms. There are four shorter (2.79 Å) and two longer (2.82 Å) Mn–Rh bond lengths. There are two shorter (2.46 Å) and two longer (2.57 Å) Mn–As bond lengths. Rh is bonded in a 11-coordinate geometry to six equivalent Mn and five As atoms. There are one shorter (2.53 Å) and four longer (2.70 Å) Rh–As bond lengths. There are two inequivalent As sites. In the first As site, As is bonded in a 9-coordinate geometry to six equivalent Mn and three equivalent Rh atoms. In the second As site, As is bonded in a distorted trigonal planar geometry to three equivalent Mn and six equivalent Rh atoms.
DOI: 10.17188/1195347
title: Materials Data on Sm(Sn3Ru2)2 by Materials Project

description: Sm(Ru2Sn3)2 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Sm is bonded in a 12-coordinate geometry to four equivalent Ru and twelve Sn atoms. All Sm–Ru bond lengths are 3.30 Å. There are a spread of Sm–Sn bond distances ranging from 3.39–3.77 Å. Ru is bonded in a 7-coordinate geometry to one Sm, two equivalent Ru, and six Sn atoms. Both Ru–Ru bond lengths are 2.85 Å. There are a spread of Ru–Sn bond distances ranging from 2.60–2.80 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 6-coordinate geometry to two equivalent Sm and four equivalent Ru atoms. In the second Sn site, Sn is bonded in a 5-coordinate geometry to two equivalent Sm and four equivalent Ru atoms.
DOI: 10.17188/1195348
title: Materials Data on Eu2ReO5 by Materials Project

description: Eu2ReO5 crystallizes in the tetragonal P4/n space group. The structure is three-dimensional. Eu3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Eu–O bond distances ranging from 2.32–2.70 Å. There are two inequivalent Re4+ sites. In the first Re4+ site, Re4+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Re–O bond lengths are 1.90 Å. In the second Re4+ site, Re4+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Re–O bond lengths are 1.89 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent Eu3+ atoms to form a mixture of corner and edge-sharing OEu4 tetrahedra. In the second O2- site, O2- is bonded to four equivalent Eu3+ atoms to form OEu4 tetrahedra that share corners with twelve equivalent OEu3Re tetrahedra and edges with two equivalent OEu4 tetrahedra. In the third O2- site, O2- is bonded in a 1-coordinate geometry to three equivalent Eu3+ and one Re4+ atom. In the fourth O2- site, O2- is bonded to three equivalent Eu3+ and one Re4+ atom to form a mixture of distorted corner and edge-sharing OEu3Re tetrahedra.
DOI: 10.17188/1195349
title: Materials Data on Ag2PbO2 by Materials Project

description: Ag2PbO2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are two inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.12 Å. In the second Ag1+ site, Ag1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.13 Å. Pb2+ is bonded in a rectangular see-saw-like geometry to four equivalent O2- atoms. There are two shorter (2.28 Å) and two longer (2.47 Å) Pb–O bond lengths. O2- is bonded to two Ag1+ and two equivalent Pb2+ atoms to form a mixture of distorted edge and corner-sharing OAg2Pb2 tetrahedra.
DOI: 10.17188/1195350
title: Materials Data on Mn3Si by Materials Project

description: Mn3Si is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mn sites. In the first Mn site, Mn is bonded in a distorted body-centered cubic geometry to four equivalent Mn and four equivalent Si atoms. All Mn–Mn bond lengths are 2.45 Å. All Mn–Si bond lengths are 2.45 Å. In the second Mn site, Mn is bonded in a 8-coordinate geometry to eight equivalent Mn and six equivalent Si atoms. All Mn–Si bond lengths are 2.83 Å. Si is bonded in a distorted body-centered cubic geometry to fourteen Mn atoms.
DOI: 10.17188/1195351
title: Materials Data on BaPr2CuO5 by Materials Project

description: Pr2BaCuO5 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Ba2+ is bonded in a distorted q6 geometry to ten O2- atoms. There are two shorter (2.95 Å) and eight longer (3.00 Å) Ba–O bond lengths. Pr3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Pr–O bond distances ranging from 2.37–2.63 Å. Cu2+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Cu–O bond lengths are 1.96 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 6-coordinate geometry to two equivalent Ba2+, three equivalent Pr3+, and one Cu2+ atom. In the second O2- site, O2- is bonded to two equivalent Ba2+ and four equivalent Pr3+ atoms to form corner-sharing OBa2Pr4 octahedra. The corner-sharing octahedra tilt angles range from 0–34°.
DOI: 10.17188/1195352
title: Materials Data on Yb2MnS4 by Materials Project

description: MnYb2S4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Yb3+ is bonded to six equivalent S2- atoms to form YbS6 octahedra that share corners with six equivalent MnS4 tetrahedra and edges with six equivalent YbS6 octahedra. All Yb–S bond lengths are 2.80 Å. Mn2+ is bonded to four equivalent S2- atoms to form MnS4 tetrahedra that share corners with twelve equivalent YbS6 octahedra. The corner-sharing octahedral tilt angles are 53°. All Mn–S bond lengths are 2.23 Å. S2- is bonded in a rectangular see-saw-like geometry to three equivalent Yb3+ and one Mn2+ atom.
DOI: 10.17188/1195353
title: Materials Data on UGa3 by Materials Project

description: UGa3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. U is bonded to twelve equivalent Ga atoms to form UGa12 cuboctahedra that share corners with twelve equivalent UGa12 cuboctahedra, edges with twenty-four equivalent GaU4Ga8 cuboctahedra, faces with six equivalent UGa12 cuboctahedra, and faces with twelve equivalent GaU4Ga8 cuboctahedra. All U–Ga bond lengths are 3.00 Å. Ga is bonded to four equivalent U and eight equivalent Ga atoms to form distorted GaU4Ga8 cuboctahedra that share corners with twelve equivalent GaU4Ga8 cuboctahedra, edges with eight equivalent UGa12 cuboctahedra, edges with sixteen equivalent GaU4Ga8 cuboctahedra, faces with four equivalent UGa12 cuboctahedra, and faces with fourteen equivalent GaU4Ga8 cuboctahedra. All Ga–Ga bond lengths are 3.00 Å.
DOI: 10.17188/1195354
title: Materials Data on LaS by Materials Project

description: LaS crystallizes in the tetragonal P4/nmm space group. The structure is two-dimensional and consists of one LaS sheet oriented in the (0, 0, 1) direction. La2+ is bonded to five equivalent S2- atoms to form a mixture of distorted corner and edge-sharing LaS5 square pyramids. There are four shorter (2.90 Å) and one longer (2.93 Å) La–S bond lengths. S2- is bonded to five equivalent La2+ atoms to form a mixture of corner and edge-sharing SLa5 square pyramids.
DOI: 10.17188/1195355
title: Materials Data on EuPS3 by Materials Project

description: EuPS3 crystallizes in the monoclinic Pc space group. The structure is three-dimensional. there are two inequivalent Eu2+ sites. In the first Eu2+ site, Eu2+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Eu–S bond distances ranging from 3.02–3.20 Å. In the second Eu2+ site, Eu2+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Eu–S bond distances ranging from 3.02–3.20 Å. There are two inequivalent P4+ sites. In the first P4+ site, P4+ is bonded in a trigonal non-coplanar geometry to three S2- atoms. There are a spread of P–S bond distances ranging from 2.03–2.05 Å. In the second P4+ site, P4+ is bonded in a trigonal non-coplanar geometry to three S2- atoms. There are a spread of P–S bond distances ranging from 2.03–2.05 Å. There are six inequivalent S2- sites. In the first S2- site, S2- is bonded in a 3-coordinate geometry to two Eu2+ and one P4+ atom. In the second S2- site, S2- is bonded in a 1-coordinate geometry to three Eu2+ and one P4+ atom. In the third S2- site, S2- is bonded in a 4-coordinate geometry to three Eu2+ and one P4+ atom. In the fourth S2- site, S2- is bonded in a 3-coordinate geometry to two Eu2+ and one P4+ atom. In the fifth S2- site, S2- is bonded in a 1-coordinate geometry to three Eu2+ and one P4+ atom. In the sixth S2- site, S2- is bonded in a 4-coordinate geometry to three Eu2+ and one P4+ atom.