cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1329174
title: Materials Data on SmCu(WO4)2 by Materials Project

description: SmCu(WO4)2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Sm3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Sm–O bond distances ranging from 2.28–2.66 Å. There are two inequivalent W6+ sites. In the first W6+ site, W6+ is bonded in a distorted octahedral geometry to six O2- atoms. There are a spread of W–O bond distances ranging from 1.81–2.15 Å. In the second W6+ site, W6+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of W–O bond distances ranging from 1.81–2.32 Å. Cu1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Cu–O bond distances ranging from 1.94–2.41 Å. There are eight inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to one Sm3+, one W6+, and one Cu1+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to one Sm3+, one W6+, and one Cu1+ atom. In the third O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Sm3+ and one W6+ atom. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent Sm3+ and one W6+ atom. In the fifth O2- site, O2- is bonded in a 3-coordinate geometry to one Sm3+, one W6+, and one Cu1+ atom. In the sixth O2- site, O2- is bonded in a 3-coordinate geometry to one Sm3+ and two W6+ atoms. In the seventh O2- site, O2- is bonded to three W6+ and one Cu1+ atom to form distorted edge-sharing OCuW3 tetrahedra. In the eighth O2- site, O2- is bonded in a 3-coordinate geometry to one Sm3+ and two W6+ atoms.
DOI: 10.17188/1329279
title: Materials Data on Li3Cr2(GeO4)3 by Materials Project

description: Li3Cr2(GeO4)3 crystallizes in the cubic Ia-3d space group. The structure is three-dimensional. Li1+ is bonded in a distorted body-centered cubic geometry to eight equivalent O2- atoms. There are four shorter (2.33 Å) and four longer (2.45 Å) Li–O bond lengths. Cr+4.50+ is bonded to six equivalent O2- atoms to form CrO6 octahedra that share corners with six equivalent GeO4 tetrahedra. All Cr–O bond lengths are 1.93 Å. Ge4+ is bonded to four equivalent O2- atoms to form GeO4 tetrahedra that share corners with four equivalent CrO6 octahedra. The corner-sharing octahedral tilt angles are 49°. All Ge–O bond lengths are 1.77 Å. O2- is bonded in a 4-coordinate geometry to two equivalent Li1+, one Cr+4.50+, and one Ge4+ atom.
DOI: 10.17188/1330005
title: Materials Data on Ca3N2 by Materials Project

description: Ca3N2 crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Ca3N framework. In the Ca3N framework, Ca2+ is bonded in a linear geometry to two equivalent N3- atoms. Both Ca–N bond lengths are 2.30 Å. N3- is bonded to six equivalent Ca2+ atoms to form corner-sharing NCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330006
title: Materials Data on VS2 by Materials Project

description: VS2 is Molybdenite structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of two VS2 sheets oriented in the (0, 0, 1) direction. V4+ is bonded to six equivalent S2- atoms to form distorted edge-sharing VS6 pentagonal pyramids. All V–S bond lengths are 2.37 Å. S2- is bonded in a 3-coordinate geometry to three equivalent V4+ atoms.
DOI: 10.17188/1330007
title: Materials Data on VS2 by Materials Project

description: VS2 is trigonal omega-like structured and crystallizes in the trigonal R-3m space group. The structure is two-dimensional and consists of three VS2 sheets oriented in the (0, 0, 1) direction. V4+ is bonded to six equivalent S2- atoms to form edge-sharing VS6 octahedra. All V–S bond lengths are 2.36 Å. S2- is bonded in a distorted T-shaped geometry to three equivalent V4+ atoms.
DOI: 10.17188/1330008
title: Materials Data on BeGeP2 by Materials Project

description: BeGeP2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Be2+ is bonded to four equivalent P3- atoms to form BeP4 tetrahedra that share corners with four equivalent BeP4 tetrahedra and corners with eight equivalent GeP4 tetrahedra. All Be–P bond lengths are 2.18 Å. Ge4+ is bonded to four equivalent P3- atoms to form GeP4 tetrahedra that share corners with four equivalent GeP4 tetrahedra and corners with eight equivalent BeP4 tetrahedra. All Ge–P bond lengths are 2.35 Å. P3- is bonded to two equivalent Be2+ and two equivalent Ge4+ atoms to form corner-sharing PBe2Ge2 tetrahedra.
DOI: 10.17188/1330009
title: Materials Data on Ba3N2 by Materials Project

description: Ba3N2 is alpha Rhenium trioxide-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Ba3N framework. In the Ba3N framework, Ba2+ is bonded in a linear geometry to two equivalent N3- atoms. Both Ba–N bond lengths are 2.68 Å. N3- is bonded to six equivalent Ba2+ atoms to form corner-sharing NBa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330010
title: Materials Data on Sr3N2 by Materials Project

description: Sr3N2 is High-temperature superconductor-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Sr3N framework. In the Sr3N framework, Sr2+ is bonded in a linear geometry to two equivalent N3- atoms. Both Sr–N bond lengths are 2.49 Å. N3- is bonded to six equivalent Sr2+ atoms to form corner-sharing NSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330011
title: Materials Data on Sr3BiP by Materials Project

description: Sr3BiP is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one phosphine molecule and one Sr3Bi framework. In the Sr3Bi framework, Sr is bonded in a linear geometry to two equivalent Bi atoms. Both Sr–Bi bond lengths are 3.09 Å. Bi is bonded to six equivalent Sr atoms to form corner-sharing BiSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330012
title: Materials Data on Sr3BiN by Materials Project

description: BiNSr3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Sr3Bi framework. In the Sr3Bi framework, Sr is bonded in a linear geometry to two equivalent Bi atoms. Both Sr–Bi bond lengths are 3.12 Å. Bi is bonded to six equivalent Sr atoms to form corner-sharing BiSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330013
title: Materials Data on Sr3AsP by Materials Project

description: Sr3AsP is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one phosphine molecule and one Sr3As framework. In the Sr3As framework, Sr2+ is bonded in a linear geometry to two equivalent As3- atoms. Both Sr–As bond lengths are 2.90 Å. As3- is bonded to six equivalent Sr2+ atoms to form corner-sharing AsSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330014
title: Materials Data on Ba3PN by Materials Project

description: Ba3PN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ba2+ is bonded in a linear geometry to four equivalent P3- and two equivalent N3- atoms. All Ba–P bond lengths are 3.85 Å. Both Ba–N bond lengths are 2.73 Å. P3- is bonded to twelve equivalent Ba2+ atoms to form PBa12 cuboctahedra that share corners with twelve equivalent PBa12 cuboctahedra, faces with six equivalent PBa12 cuboctahedra, and faces with eight equivalent NBa6 octahedra. N3- is bonded to six equivalent Ba2+ atoms to form NBa6 octahedra that share corners with six equivalent NBa6 octahedra and faces with eight equivalent PBa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330015
title: Materials Data on Sr3SbN by Materials Project

description: SbNSr3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Sr3Sb framework. In the Sr3Sb framework, Sr2+ is bonded in a linear geometry to two equivalent Sb3- atoms. Both Sr–Sb bond lengths are 3.11 Å. Sb3- is bonded to six equivalent Sr2+ atoms to form corner-sharing SbSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330016
title: Materials Data on Sr3SbP by Materials Project

description: Sr3SbP is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one phosphine molecule and one Sr3Sb framework. In the Sr3Sb framework, Sr2+ is bonded in a linear geometry to two equivalent Sb3- atoms. Both Sr–Sb bond lengths are 3.05 Å. Sb3- is bonded to six equivalent Sr2+ atoms to form corner-sharing SbSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330017
title: Materials Data on Sr3PN by Materials Project

description: (Sr3P)2N2 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Sr3P framework. In the Sr3P framework, Sr2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Sr–P bond lengths are 2.83 Å. P3- is bonded to six equivalent Sr2+ atoms to form corner-sharing PSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330018
title: Materials Data on Sr3AsN by Materials Project

description: AsNSr3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Sr3As framework. In the Sr3As framework, Sr2+ is bonded in a linear geometry to two equivalent As3- atoms. Both Sr–As bond lengths are 2.90 Å. As3- is bonded to six equivalent Sr2+ atoms to form corner-sharing AsSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330019
title: Materials Data on Ca3PN by Materials Project

description: Ca3PN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Ca3P framework. In the Ca3P framework, Ca2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Ca–P bond lengths are 2.65 Å. P3- is bonded to six equivalent Ca2+ atoms to form corner-sharing PCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330020
title: Materials Data on Sr3SbAs by Materials Project

description: Sr3SbAs is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one arsenic molecule and one Sr3Sb framework. In the Sr3Sb framework, Sr2+ is bonded in a linear geometry to two equivalent Sb3- atoms. Both Sr–Sb bond lengths are 3.06 Å. Sb3- is bonded to six equivalent Sr2+ atoms to form corner-sharing SbSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330021
title: Materials Data on Ca3BiN by Materials Project

description: BiNCa3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Ca3Bi framework. In the Ca3Bi framework, Ca is bonded in a linear geometry to two equivalent Bi atoms. Both Ca–Bi bond lengths are 2.92 Å. Bi is bonded to six equivalent Ca atoms to form corner-sharing BiCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330022
title: Materials Data on Ca3AsN by Materials Project

description: Ca3AsN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one ammonia molecule and one Ca3As framework. In the Ca3As framework, Ca2+ is bonded in a linear geometry to two equivalent As3- atoms. Both Ca–As bond lengths are 2.71 Å. As3- is bonded to six equivalent Ca2+ atoms to form corner-sharing AsCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330023
title: Materials Data on Ca3SbAs by Materials Project

description: Ca3SbAs is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ca2+ is bonded in a linear geometry to four equivalent Sb3- and two equivalent As3- atoms. All Ca–Sb bond lengths are 3.88 Å. Both Ca–As bond lengths are 2.74 Å. Sb3- is bonded to twelve equivalent Ca2+ atoms to form SbCa12 cuboctahedra that share corners with twelve equivalent SbCa12 cuboctahedra, faces with six equivalent SbCa12 cuboctahedra, and faces with eight equivalent AsCa6 octahedra. As3- is bonded to six equivalent Ca2+ atoms to form AsCa6 octahedra that share corners with six equivalent AsCa6 octahedra and faces with eight equivalent SbCa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330024
title: Materials Data on Ca3BiAs by Materials Project

description: Ca3BiAs is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ca is bonded in a linear geometry to four equivalent Bi and two equivalent As atoms. All Ca–Bi bond lengths are 3.91 Å. Both Ca–As bond lengths are 2.77 Å. Bi is bonded to twelve equivalent Ca atoms to form BiCa12 cuboctahedra that share corners with twelve equivalent BiCa12 cuboctahedra, faces with six equivalent BiCa12 cuboctahedra, and faces with eight equivalent AsCa6 octahedra. As is bonded to six equivalent Ca atoms to form AsCa6 octahedra that share corners with six equivalent AsCa6 octahedra and faces with eight equivalent BiCa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330025
title: Materials Data on Ca3Sb2 by Materials Project

description: Ca3Sb2 is High-temperature superconductor-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one antimony molecule and one Ca3Sb framework. In the Ca3Sb framework, Ca2+ is bonded in a linear geometry to two equivalent Sb3- atoms. Both Ca–Sb bond lengths are 2.89 Å. Sb3- is bonded to six equivalent Ca2+ atoms to form corner-sharing SbCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330026
title: Materials Data on Ca3P2 by Materials Project

description: Ca3P2 is High-temperature superconductor-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one phosphine molecule and one Ca3P framework. In the Ca3P framework, Ca2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Ca–P bond lengths are 2.65 Å. P3- is bonded to six equivalent Ca2+ atoms to form corner-sharing PCa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330027
title: Materials Data on Ca3SbN by Materials Project

description: SbNCa3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ca2+ is bonded in a linear geometry to four equivalent Sb3- and two equivalent N3- atoms. All Ca–Sb bond lengths are 3.45 Å. Both Ca–N bond lengths are 2.44 Å. Sb3- is bonded to twelve equivalent Ca2+ atoms to form SbCa12 cuboctahedra that share corners with twelve equivalent SbCa12 cuboctahedra, faces with six equivalent SbCa12 cuboctahedra, and faces with eight equivalent NCa6 octahedra. N3- is bonded to six equivalent Ca2+ atoms to form NCa6 octahedra that share corners with six equivalent NCa6 octahedra and faces with eight equivalent SbCa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330028
title: Materials Data on Ba3BiN by Materials Project

description: BiNBa3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ba is bonded in a linear geometry to four equivalent Bi and two equivalent N atoms. All Ba–Bi bond lengths are 3.97 Å. Both Ba–N bond lengths are 2.81 Å. Bi is bonded to twelve equivalent Ba atoms to form BiBa12 cuboctahedra that share corners with twelve equivalent BiBa12 cuboctahedra, faces with six equivalent BiBa12 cuboctahedra, and faces with eight equivalent NBa6 octahedra. N is bonded to six equivalent Ba atoms to form NBa6 octahedra that share corners with six equivalent NBa6 octahedra and faces with eight equivalent BiBa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330029
title: Materials Data on Ca3SbP by Materials Project

description: Ca3SbP is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ca2+ is bonded in a linear geometry to four equivalent Sb3- and two equivalent P3- atoms. All Ca–Sb bond lengths are 3.81 Å. Both Ca–P bond lengths are 2.69 Å. Sb3- is bonded to twelve equivalent Ca2+ atoms to form SbCa12 cuboctahedra that share corners with twelve equivalent SbCa12 cuboctahedra, faces with six equivalent SbCa12 cuboctahedra, and faces with eight equivalent PCa6 octahedra. P3- is bonded to six equivalent Ca2+ atoms to form PCa6 octahedra that share corners with six equivalent PCa6 octahedra and faces with eight equivalent SbCa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330030
title: Materials Data on Ba3P2 by Materials Project

description: Ba3P2 is alpha Rhenium trioxide-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one phosphine molecule and one Ba3P framework. In the Ba3P framework, Ba2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Ba–P bond lengths are 3.02 Å. P3- is bonded to six equivalent Ba2+ atoms to form corner-sharing PBa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330031
title: Materials Data on Sr3P2 by Materials Project

description: Sr3P2 is alpha Rhenium trioxide-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one phosphine molecule and one Sr3P framework. In the Sr3P framework, Sr2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Sr–P bond lengths are 2.83 Å. P3- is bonded to six equivalent Sr2+ atoms to form corner-sharing PSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330032
title: Materials Data on Sr3AsP by Materials Project

description: Sr3PAs is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one arsenic molecule and one Sr3P framework. In the Sr3P framework, Sr2+ is bonded in a linear geometry to two equivalent P3- atoms. Both Sr–P bond lengths are 2.85 Å. P3- is bonded to six equivalent Sr2+ atoms to form corner-sharing PSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330033
title: Materials Data on Sr3PN by Materials Project

description: Sr3PN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sr2+ is bonded in a linear geometry to four equivalent P3- and two equivalent N3- atoms. All Sr–P bond lengths are 3.59 Å. Both Sr–N bond lengths are 2.54 Å. P3- is bonded to twelve equivalent Sr2+ atoms to form PSr12 cuboctahedra that share corners with twelve equivalent PSr12 cuboctahedra, faces with six equivalent PSr12 cuboctahedra, and faces with eight equivalent NSr6 octahedra. N3- is bonded to six equivalent Sr2+ atoms to form NSr6 octahedra that share corners with six equivalent NSr6 octahedra and faces with eight equivalent PSr12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330034
title: Materials Data on Sr3AsN by Materials Project

description: AsNSr3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sr2+ is bonded in a linear geometry to four equivalent As3- and two equivalent N3- atoms. All Sr–As bond lengths are 3.62 Å. Both Sr–N bond lengths are 2.56 Å. As3- is bonded to twelve equivalent Sr2+ atoms to form AsSr12 cuboctahedra that share corners with twelve equivalent AsSr12 cuboctahedra, faces with six equivalent AsSr12 cuboctahedra, and faces with eight equivalent NSr6 octahedra. N3- is bonded to six equivalent Sr2+ atoms to form NSr6 octahedra that share corners with six equivalent NSr6 octahedra and faces with eight equivalent AsSr12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330035
title: Materials Data on Ba3SbN by Materials Project

description: SbNBa3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ba2+ is bonded in a linear geometry to four equivalent Sb3- and two equivalent N3- atoms. All Ba–Sb bond lengths are 3.94 Å. Both Ba–N bond lengths are 2.79 Å. Sb3- is bonded to twelve equivalent Ba2+ atoms to form SbBa12 cuboctahedra that share corners with twelve equivalent SbBa12 cuboctahedra, faces with six equivalent SbBa12 cuboctahedra, and faces with eight equivalent NBa6 octahedra. N3- is bonded to six equivalent Ba2+ atoms to form NBa6 octahedra that share corners with six equivalent NBa6 octahedra and faces with eight equivalent SbBa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330036
title: Materials Data on Ca3BiP by Materials Project

description: Ca3BiP is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Ca is bonded in a linear geometry to four equivalent Bi and two equivalent P atoms. All Ca–Bi bond lengths are 3.84 Å. Both Ca–P bond lengths are 2.71 Å. Bi is bonded to twelve equivalent Ca atoms to form BiCa12 cuboctahedra that share corners with twelve equivalent BiCa12 cuboctahedra, faces with six equivalent BiCa12 cuboctahedra, and faces with eight equivalent PCa6 octahedra. P is bonded to six equivalent Ca atoms to form PCa6 octahedra that share corners with six equivalent PCa6 octahedra and faces with eight equivalent BiCa12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330037
title: Materials Data on Sr3As2 by Materials Project

description: Sr3AsAs is alpha Rhenium trioxide-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one arsenic molecule and one Sr3As framework. In the Sr3As framework, Sr2+ is bonded in a linear geometry to two equivalent As3- atoms. Both Sr–As bond lengths are 2.90 Å. As3- is bonded to six equivalent Sr2+ atoms to form corner-sharing AsSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330038
title: Materials Data on Ba3As2 by Materials Project

description: Ba3AsAs is alpha Rhenium trioxide-like structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one arsenic molecule and one Ba3As framework. In the Ba3As framework, Ba2+ is bonded in a linear geometry to two equivalent As3- atoms. Both Ba–As bond lengths are 3.09 Å. As3- is bonded to six equivalent Ba2+ atoms to form corner-sharing AsBa6 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1330039
title: Materials Data on Sr3SbAs by Materials Project

description: Sr3AsSb is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional and consists of one stibium metallicum molecule and one Sr3As framework. In the Sr3As framework, Sr2+ is bonded in a linear geometry to two equivalent As3- atoms. Both Sr–As bond lengths are 2.92 Å. As3- is bonded to six equivalent Sr2+ atoms to form corner-sharing AsSr6 octahedra. The corner-sharing octahedral tilt angles are 0°.