cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1310338
title: Materials Data on HfGaRh2 by Materials Project

description: HfRh2Ga is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Hf–Rh bond lengths are 2.74 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Ga atoms. All Rh–Ga bond lengths are 2.74 Å. Ga is bonded in a distorted body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1310339
title: Materials Data on HfMgIr2 by Materials Project

description: MgHfIr2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. All Mg–Ir bond lengths are 2.77 Å. Hf is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. All Hf–Ir bond lengths are 2.77 Å. Ir is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Hf atoms.
DOI: 10.17188/1310340
title: Materials Data on Be2RuPt by Materials Project

description: Be2RuPt is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Be is bonded in a body-centered cubic geometry to four equivalent Ru and four equivalent Pt atoms. All Be–Ru bond lengths are 2.44 Å. All Be–Pt bond lengths are 2.44 Å. Ru is bonded in a body-centered cubic geometry to eight equivalent Be atoms. Pt is bonded in a body-centered cubic geometry to eight equivalent Be atoms.
DOI: 10.17188/1310341
title: Materials Data on MnIr3 by Materials Project

description: MnIr3 is Uranium Silicide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Mn is bonded to twelve equivalent Ir atoms to form MnIr12 cuboctahedra that share corners with six equivalent MnIr12 cuboctahedra, corners with twelve equivalent IrMn4Ir8 cuboctahedra, edges with eighteen equivalent IrMn4Ir8 cuboctahedra, faces with eight equivalent MnIr12 cuboctahedra, and faces with twelve equivalent IrMn4Ir8 cuboctahedra. There are six shorter (2.67 Å) and six longer (2.73 Å) Mn–Ir bond lengths. Ir is bonded to four equivalent Mn and eight equivalent Ir atoms to form distorted IrMn4Ir8 cuboctahedra that share corners with four equivalent MnIr12 cuboctahedra, corners with fourteen equivalent IrMn4Ir8 cuboctahedra, edges with six equivalent MnIr12 cuboctahedra, edges with twelve equivalent IrMn4Ir8 cuboctahedra, faces with four equivalent MnIr12 cuboctahedra, and faces with sixteen equivalent IrMn4Ir8 cuboctahedra. There are six shorter (2.69 Å) and two longer (2.76 Å) Ir–Ir bond lengths.
DOI: 10.17188/1310342
title: Materials Data on HfTc2Sb by Materials Project

description: HfTc2Sb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hf4+ is bonded in a distorted body-centered cubic geometry to eight equivalent Tc+0.50- and six equivalent Sb3- atoms. All Hf–Tc bond lengths are 2.81 Å. All Hf–Sb bond lengths are 3.25 Å. Tc+0.50- is bonded in a body-centered cubic geometry to four equivalent Hf4+ and four equivalent Sb3- atoms. All Tc–Sb bond lengths are 2.81 Å. Sb3- is bonded in a 8-coordinate geometry to six equivalent Hf4+ and eight equivalent Tc+0.50- atoms.
DOI: 10.17188/1310343
title: Materials Data on HfTaRe2 by Materials Project

description: HfTaRe2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to eight equivalent Re atoms. All Hf–Re bond lengths are 2.81 Å. Ta is bonded in a body-centered cubic geometry to eight equivalent Re atoms. All Ta–Re bond lengths are 2.81 Å. Re is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Ta atoms.
DOI: 10.17188/1310344
title: Materials Data on Mn2VSi by Materials Project

description: Mn2VSi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. V is bonded in a distorted body-centered cubic geometry to eight equivalent Mn and six equivalent Si atoms. All V–Mn bond lengths are 2.46 Å. All V–Si bond lengths are 2.84 Å. Mn is bonded in a body-centered cubic geometry to four equivalent V and four equivalent Si atoms. All Mn–Si bond lengths are 2.46 Å. Si is bonded in a body-centered cubic geometry to six equivalent V and eight equivalent Mn atoms.
DOI: 10.17188/1310345
title: Materials Data on Mn3Ge by Materials Project

description: Mn3Ge 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 to four equivalent Mn and four equivalent Ge atoms to form a mixture of distorted face, edge, and corner-sharing MnMn4Ge4 tetrahedra. All Mn–Mn bond lengths are 2.50 Å. All Mn–Ge bond lengths are 2.50 Å. In the second Mn site, Mn is bonded in a 8-coordinate geometry to eight equivalent Mn and six equivalent Ge atoms. All Mn–Ge bond lengths are 2.88 Å. Ge is bonded in a distorted body-centered cubic geometry to fourteen Mn atoms.
DOI: 10.17188/1310346
title: Materials Data on AcTlTe2 by Materials Project

description: AcTlTe2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ac3+ is bonded in a body-centered cubic geometry to eight equivalent Te2- atoms. All Ac–Te bond lengths are 3.53 Å. Tl1+ is bonded in a body-centered cubic geometry to eight equivalent Te2- atoms. All Tl–Te bond lengths are 3.53 Å. Te2- is bonded in a body-centered cubic geometry to four equivalent Ac3+ and four equivalent Tl1+ atoms.
DOI: 10.17188/1310347
title: Materials Data on LiPaRu2 by Materials Project

description: LiPaRu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Li–Ru bond lengths are 2.78 Å. Pa is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Pa–Ru bond lengths are 2.78 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Pa atoms.
DOI: 10.17188/1310348
title: Materials Data on HfScRu2 by Materials Project

description: ScHfRu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sc is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Sc–Ru bond lengths are 2.79 Å. Hf is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Hf–Ru bond lengths are 2.79 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Sc and four equivalent Hf atoms.
DOI: 10.17188/1310349
title: Materials Data on Mg2ZnB2Ir5 by Materials Project

description: Mg2Ir5ZnB2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Mg is bonded in a 11-coordinate geometry to ten Ir and one B atom. There are a spread of Mg–Ir bond distances ranging from 2.79–2.95 Å. The Mg–B bond length is 2.64 Å. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a 8-coordinate geometry to four equivalent Mg, two equivalent Zn, and two equivalent B atoms. Both Ir–Zn bond lengths are 2.61 Å. Both Ir–B bond lengths are 2.17 Å. In the second Ir site, Ir is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent B atoms. All Ir–B bond lengths are 2.25 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. B is bonded in a 7-coordinate geometry to one Mg and six Ir atoms.
DOI: 10.17188/1310350
title: Materials Data on Mn2PtRh by Materials Project

description: Mn2RhPt is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mn is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent Pt atoms. All Mn–Rh bond lengths are 2.67 Å. All Mn–Pt bond lengths are 2.67 Å. Rh is bonded in a body-centered cubic geometry to eight equivalent Mn atoms. Pt is bonded in a body-centered cubic geometry to eight equivalent Mn atoms.
DOI: 10.17188/1310351
title: Materials Data on CeMgAg2 by Materials Project

description: MgCeAg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Ag atoms. All Mg–Ag bond lengths are 3.10 Å. Ce is bonded in a body-centered cubic geometry to eight equivalent Ag atoms. All Ce–Ag bond lengths are 3.10 Å. Ag is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Ce atoms.
DOI: 10.17188/1310352
title: Materials Data on HfTaTc2 by Materials Project

description: HfTaTc2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to eight equivalent Tc atoms. All Hf–Tc bond lengths are 2.79 Å. Ta is bonded in a body-centered cubic geometry to eight equivalent Tc atoms. All Ta–Tc bond lengths are 2.79 Å. Tc is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Ta atoms.
DOI: 10.17188/1310353
title: Materials Data on HfTc2Sn by Materials Project

description: HfTc2Sn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hf4+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms. All Hf–Tc bond lengths are 2.82 Å. Tc3- is bonded in a distorted body-centered cubic geometry to four equivalent Hf4+ and four equivalent Sn2+ atoms. All Tc–Sn bond lengths are 2.82 Å. Sn2+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms.
DOI: 10.17188/1310354
title: Materials Data on HfScRh2 by Materials Project

description: ScHfRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sc is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Sc–Rh bond lengths are 2.82 Å. Hf is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Hf–Rh bond lengths are 2.82 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Sc and four equivalent Hf atoms.
DOI: 10.17188/1310360
title: Materials Data on MgInPd2 by Materials Project

description: MgPd2In is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Pd atoms. All Mg–Pd bond lengths are 2.81 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent In atoms. All Pd–In bond lengths are 2.81 Å. In is bonded in a distorted body-centered cubic geometry to eight equivalent Pd atoms.
DOI: 10.17188/1310361
title: Materials Data on MgInIr2 by Materials Project

description: MgIr2In is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. All Mg–Ir bond lengths are 2.76 Å. Ir is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent In atoms. All Ir–In bond lengths are 2.76 Å. In is bonded in a distorted body-centered cubic geometry to eight equivalent Ir atoms.
DOI: 10.17188/1310362
title: Materials Data on MnRu3 by Materials Project

description: MnRu3 is Uranium Silicide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Mn is bonded to twelve equivalent Ru atoms to form MnRu12 cuboctahedra that share corners with six equivalent MnRu12 cuboctahedra, corners with twelve equivalent RuMn4Ru8 cuboctahedra, edges with eighteen equivalent RuMn4Ru8 cuboctahedra, faces with eight equivalent MnRu12 cuboctahedra, and faces with twelve equivalent RuMn4Ru8 cuboctahedra. There are six shorter (2.61 Å) and six longer (2.69 Å) Mn–Ru bond lengths. Ru is bonded to four equivalent Mn and eight equivalent Ru atoms to form distorted RuMn4Ru8 cuboctahedra that share corners with four equivalent MnRu12 cuboctahedra, corners with fourteen equivalent RuMn4Ru8 cuboctahedra, edges with six equivalent MnRu12 cuboctahedra, edges with twelve equivalent RuMn4Ru8 cuboctahedra, faces with four equivalent MnRu12 cuboctahedra, and faces with sixteen equivalent RuMn4Ru8 cuboctahedra. There are a spread of Ru–Ru bond distances ranging from 2.64–2.74 Å.
DOI: 10.17188/1310363
title: Materials Data on LiPaPt2 by Materials Project

description: LiPaPt2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li1+ is bonded in a body-centered cubic geometry to eight equivalent Pt2- atoms. All Li–Pt bond lengths are 2.90 Å. Pa3+ is bonded in a body-centered cubic geometry to eight equivalent Pt2- atoms. All Pa–Pt bond lengths are 2.90 Å. Pt2- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Pa3+ atoms.
DOI: 10.17188/1310364
title: Materials Data on Mg2AlB2Ir5 by Materials Project

description: Mg2Ir5AlB2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 11-coordinate geometry to two equivalent Mg, ten Ir, and three B atoms. Both Mg–Mg bond lengths are 2.93 Å. There are a spread of Mg–Ir bond distances ranging from 2.78–2.96 Å. There are one shorter (2.66 Å) and two longer (2.90 Å) Mg–B bond lengths. In the second Mg site, Mg is bonded in a 11-coordinate geometry to two equivalent Mg, ten Ir, and three B atoms. Both Mg–Mg bond lengths are 2.93 Å. There are a spread of Mg–Ir bond distances ranging from 2.78–2.96 Å. There are one shorter (2.66 Å) and two longer (2.90 Å) Mg–B bond lengths. There are two inequivalent Ir sites. In the first Ir site, Ir is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent B atoms. All Ir–B bond lengths are 2.23 Å. In the second Ir site, Ir is bonded in a 8-coordinate geometry to four Mg, two equivalent Al, and two equivalent B atoms. Both Ir–Al bond lengths are 2.59 Å. Both Ir–B bond lengths are 2.18 Å. Al is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. There are two inequivalent B sites. In the first B site, B is bonded in a 7-coordinate geometry to three Mg and six Ir atoms. In the second B site, B is bonded in a 7-coordinate geometry to three Mg and six Ir atoms. There are four shorter (2.18 Å) and two longer (2.23 Å) B–Ir bond lengths.
DOI: 10.17188/1310365
title: Materials Data on TiZnIr2 by Materials Project

description: TiIr2Zn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ti is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. All Ti–Ir bond lengths are 2.66 Å. Ir is bonded in a body-centered cubic geometry to four equivalent Ti and four equivalent Zn atoms. All Ir–Zn bond lengths are 2.66 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Ir atoms.
DOI: 10.17188/1310366
title: Materials Data on HfMgPd2 by Materials Project

description: MgHfPd2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Pd atoms. All Mg–Pd bond lengths are 2.82 Å. Hf is bonded in a body-centered cubic geometry to eight equivalent Pd atoms. All Hf–Pd bond lengths are 2.82 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Hf atoms.
DOI: 10.17188/1310367
title: Materials Data on HfMgRh2 by Materials Project

description: MgHfRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Mg–Rh bond lengths are 2.76 Å. Hf is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Hf–Rh bond lengths are 2.76 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Hf atoms.
DOI: 10.17188/1310368
title: Materials Data on NaCa2Tl by Materials Project

description: NaCa2Tl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to eight equivalent Ca atoms. All Na–Ca bond lengths are 3.44 Å. Ca is bonded in a distorted body-centered cubic geometry to four equivalent Na and four equivalent Tl atoms. All Ca–Tl bond lengths are 3.44 Å. Tl is bonded in a body-centered cubic geometry to eight equivalent Ca atoms.
DOI: 10.5281/zenodo.4482118
title: In situ Pd oxidation

description: In situ Pd oxidation
DOI: 10.17188/1310369
title: Materials Data on HfInRh2 by Materials Project

description: HfRh2In is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Hf–Rh bond lengths are 2.81 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent In atoms. All Rh–In bond lengths are 2.81 Å. In is bonded in a distorted body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.5281/zenodo.4482117
title: In situ Pd oxidation

description: In situ Pd oxidation
DOI: 10.17188/1310370
title: Materials Data on Li2EuGe by Materials Project

description: Li2EuGe is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Li is bonded in a body-centered cubic geometry to four equivalent Eu and four equivalent Ge atoms. All Li–Eu bond lengths are 2.92 Å. All Li–Ge bond lengths are 2.92 Å. Eu is bonded in a distorted body-centered cubic geometry to eight equivalent Li and six equivalent Ge atoms. All Eu–Ge bond lengths are 3.37 Å. Ge is bonded in a body-centered cubic geometry to eight equivalent Li and six equivalent Eu atoms.
DOI: 10.17188/1310371
title: Materials Data on NaCd2Pt by Materials Project

description: NaPtCd2 is Heusler 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 six equivalent Pt and eight equivalent Cd atoms. All Na–Pt bond lengths are 3.39 Å. All Na–Cd bond lengths are 2.94 Å. Pt is bonded in a distorted body-centered cubic geometry to six equivalent Na and eight equivalent Cd atoms. All Pt–Cd bond lengths are 2.94 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Pt atoms.
DOI: 10.17188/1310372
title: Materials Data on NaCd3 by Materials Project

description: NaCd3 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 Cd atoms. There are eight shorter (3.13 Å) and six longer (3.62 Å) Na–Cd bond lengths. There are two inequivalent Cd sites. In the first Cd site, Cd is bonded to four equivalent Na and four equivalent Cd atoms to form a mixture of distorted face, edge, and corner-sharing CdNa4Cd4 tetrahedra. All Cd–Cd bond lengths are 3.13 Å. In the second Cd site, Cd is bonded in a 8-coordinate geometry to six equivalent Na and eight equivalent Cd atoms.
DOI: 10.17188/1310373
title: Materials Data on Gd2Mg by Materials Project

description: MgGd2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to eight Gd atoms. There are a spread of Mg–Gd bond distances ranging from 3.32–3.38 Å. There are two inequivalent Gd sites. In the first Gd site, Gd is bonded in a 12-coordinate geometry to six equivalent Mg and four equivalent Gd atoms. There are two shorter (3.65 Å) and two longer (3.67 Å) Gd–Gd bond lengths. In the second Gd site, Gd is bonded to two equivalent Mg and ten Gd atoms to form a mixture of distorted face, edge, and corner-sharing GdGd10Mg2 cuboctahedra. There are four shorter (3.44 Å) and two longer (3.73 Å) Gd–Gd bond lengths.
DOI: 10.17188/1310374
title: Materials Data on TiZnPd2 by Materials Project

description: TiPd2Zn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ti is bonded in a body-centered cubic geometry to eight equivalent Pd atoms. All Ti–Pd bond lengths are 2.70 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Ti and four equivalent Zn atoms. All Pd–Zn bond lengths are 2.70 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Pd atoms.
DOI: 10.17188/1310375
title: Materials Data on NaCeAu2 by Materials Project

description: NaCeAu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Na–Au bond lengths are 3.12 Å. Ce is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Ce–Au bond lengths are 3.12 Å. Au is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Ce atoms.
DOI: 10.17188/1310376
title: Materials Data on NaAcTe2 by Materials Project

description: NaAcTe2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na1+ is bonded in a body-centered cubic geometry to eight equivalent Te2- atoms. All Na–Te bond lengths are 3.48 Å. Ac3+ is bonded in a body-centered cubic geometry to eight equivalent Te2- atoms. All Ac–Te bond lengths are 3.48 Å. Te2- is bonded in a body-centered cubic geometry to four equivalent Na1+ and four equivalent Ac3+ atoms.
DOI: 10.17188/1310377
title: Materials Data on NaCaAu2 by Materials Project

description: NaCaAu2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Na–Au bond lengths are 3.11 Å. Ca is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Ca–Au bond lengths are 3.11 Å. Au is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Ca atoms.
DOI: 10.17188/1310378
title: Materials Data on MnGaIr2 by Materials Project

description: MnIr2Ga is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Mn is bonded in a body-centered cubic geometry to eight equivalent Ir atoms. All Mn–Ir bond lengths are 2.64 Å. Ir is bonded in a body-centered cubic geometry to four equivalent Mn and four equivalent Ga atoms. All Ir–Ga bond lengths are 2.64 Å. Ga is bonded in a body-centered cubic geometry to eight equivalent Ir atoms.
DOI: 10.17188/1310379
title: Materials Data on NaCeTl2 by Materials Project

description: NaCeTl2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Na–Tl bond lengths are 3.33 Å. Ce is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Ce–Tl bond lengths are 3.33 Å. Tl is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Ce atoms.
DOI: 10.17188/1310380
title: Materials Data on NaAcTl2 by Materials Project

description: NaAcTl2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Na–Tl bond lengths are 3.47 Å. Ac is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Ac–Tl bond lengths are 3.47 Å. Tl is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Ac atoms.