cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1310428
title: Materials Data on Li2MnPO5 (SG:14) by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1310429
title: Materials Data on Hf2MnIr by Materials Project

description: Hf2MnIr 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 four equivalent Mn and four equivalent Ir atoms. All Hf–Mn bond lengths are 2.79 Å. All Hf–Ir bond lengths are 2.79 Å. Mn is bonded in a distorted body-centered cubic geometry to eight equivalent Hf and six equivalent Ir atoms. All Mn–Ir bond lengths are 3.22 Å. Ir is bonded in a body-centered cubic geometry to eight equivalent Hf and six equivalent Mn atoms.
DOI: 10.17188/1310430
title: Materials Data on LiV2CrO6 (SG:146) by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1310431
title: Materials Data on MnGaRu2 by Materials Project

description: Ru2MnGa 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 Ru atoms. All Mn–Ru bond lengths are 2.60 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Mn and four equivalent Ga atoms. All Ru–Ga bond lengths are 2.60 Å. Ga is bonded in a body-centered cubic geometry to eight equivalent Ru atoms.
DOI: 10.17188/1310432
title: Materials Data on Lu4Ni13C4 by Materials Project

description: Lu4Ni13C4 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded in a 6-coordinate geometry to fourteen Ni atoms. There are a spread of Lu–Ni bond distances ranging from 2.63–2.99 Å. In the second Lu site, Lu is bonded in a 5-coordinate geometry to eleven Ni and four equivalent C atoms. There are a spread of Lu–Ni bond distances ranging from 2.60–3.17 Å. All Lu–C bond lengths are 2.68 Å. There are five inequivalent Ni sites. In the first Ni site, Ni is bonded to four equivalent Lu and eight Ni atoms to form NiLu4Ni8 cuboctahedra that share corners with four equivalent CNi6 octahedra and faces with two equivalent NiLu4Ni8 cuboctahedra. The corner-sharing octahedral tilt angles are 34°. There are four shorter (2.38 Å) and four longer (2.48 Å) Ni–Ni bond lengths. In the second Ni site, Ni is bonded in a distorted bent 150 degrees geometry to four Lu and two C atoms. There is one shorter (1.87 Å) and one longer (1.89 Å) Ni–C bond length. In the third Ni site, Ni is bonded in a linear geometry to four Lu and two equivalent C atoms. Both Ni–C bond lengths are 1.90 Å. In the fourth Ni site, Ni is bonded in a single-bond geometry to four Lu, three Ni, and one C atom. Both Ni–Ni bond lengths are 2.39 Å. The Ni–C bond length is 1.85 Å. In the fifth Ni site, Ni is bonded in a 3-coordinate geometry to three Lu and six Ni atoms. There are two inequivalent C sites. In the first C site, C is bonded to six Ni atoms to form CNi6 octahedra that share corners with two equivalent NiLu4Ni8 cuboctahedra and corners with two equivalent CNi6 octahedra. The corner-sharing octahedral tilt angles are 0°. In the second C site, C is bonded in a 7-coordinate geometry to four equivalent Lu, two equivalent Ni, and one C atom. The C–C bond length is 1.35 Å.
DOI: 10.17188/1310433
title: Materials Data on DyMgZn2 by Materials Project

description: MgDyZn2 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 Zn atoms. All Mg–Zn bond lengths are 2.96 Å. Dy is bonded in a body-centered cubic geometry to eight equivalent Zn atoms. All Dy–Zn bond lengths are 2.96 Å. Zn is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Dy atoms.
DOI: 10.17188/1310434
title: Materials Data on BaYbCdSb2 by Materials Project

description: BaYbCdSb2 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. Ba2+ is bonded to six Sb3- atoms to form BaSb6 octahedra that share corners with two equivalent BaSb6 octahedra, corners with seven equivalent YbSb5 square pyramids, corners with six equivalent CdSb4 tetrahedra, edges with six equivalent BaSb6 octahedra, an edgeedge with one YbSb5 square pyramid, edges with three equivalent CdSb4 tetrahedra, and a faceface with one YbSb5 square pyramid. The corner-sharing octahedral tilt angles are 18°. There are a spread of Ba–Sb bond distances ranging from 3.51–3.88 Å. Yb2+ is bonded to five Sb3- atoms to form YbSb5 square pyramids that share corners with seven equivalent BaSb6 octahedra, corners with four equivalent YbSb5 square pyramids, corners with two equivalent CdSb4 tetrahedra, an edgeedge with one BaSb6 octahedra, edges with four equivalent YbSb5 square pyramids, edges with four equivalent CdSb4 tetrahedra, and a faceface with one BaSb6 octahedra. The corner-sharing octahedra tilt angles range from 36–52°. There are one shorter (3.19 Å) and four longer (3.26 Å) Yb–Sb bond lengths. Cd2+ is bonded to four Sb3- atoms to form CdSb4 tetrahedra that share corners with six equivalent BaSb6 octahedra, corners with two equivalent YbSb5 square pyramids, corners with four equivalent CdSb4 tetrahedra, edges with three equivalent BaSb6 octahedra, and edges with four equivalent YbSb5 square pyramids. The corner-sharing octahedra tilt angles range from 23–68°. There are a spread of Cd–Sb bond distances ranging from 2.89–2.99 Å. There are two inequivalent Sb3- sites. In the first Sb3- site, Sb3- is bonded in a 8-coordinate geometry to two equivalent Ba2+, four equivalent Yb2+, and two equivalent Cd2+ atoms. In the second Sb3- site, Sb3- is bonded in a 7-coordinate geometry to four equivalent Ba2+, one Yb2+, and two equivalent Cd2+ atoms.
DOI: 10.17188/1310435
title: Materials Data on CdAu3 by Materials Project

description: Au3Cd is Uranium Silicide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Au is bonded in a distorted see-saw-like geometry to four equivalent Cd atoms. There are two shorter (2.97 Å) and two longer (3.00 Å) Au–Cd bond lengths. Cd is bonded to twelve equivalent Au atoms to form a mixture of corner and face-sharing CdAu12 cuboctahedra.
DOI: 10.17188/1310436
title: Materials Data on NaTl2Bi by Materials Project

description: NaTl2Bi 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 3.43 Å. Tl is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Bi atoms. All Tl–Bi bond lengths are 3.43 Å. Bi is bonded in a body-centered cubic geometry to eight equivalent Tl atoms.
DOI: 10.17188/1310437
title: Materials Data on MgAsPt5 by Materials Project

description: MgPtAsPt4 crystallizes in the tetragonal P4/mmm space group. The structure is two-dimensional and consists of one magnesio molecule; one platinum black molecule; and one AsPt4 sheet oriented in the (0, 0, 1) direction. In the AsPt4 sheet, Pt+0.20+ is bonded in a water-like geometry to two equivalent As3- atoms. Both Pt–As bond lengths are 2.54 Å. As3- is bonded in a body-centered cubic geometry to eight equivalent Pt+0.20+ atoms.
DOI: 10.17188/1310438
title: Materials Data on Be2CuRu by Materials Project

description: Be2RuCu 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 Cu atoms. All Be–Ru bond lengths are 2.36 Å. All Be–Cu bond lengths are 2.36 Å. Ru is bonded in a body-centered cubic geometry to eight equivalent Be atoms. Cu is bonded in a distorted body-centered cubic geometry to eight equivalent Be atoms.
DOI: 10.17188/1310439
title: Materials Data on PaAlTc2 by Materials Project

description: PaTc2Al is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pa3+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms. All Pa–Tc bond lengths are 2.82 Å. Tc3- is bonded in a body-centered cubic geometry to four equivalent Pa3+ and four equivalent Al3+ atoms. All Tc–Al bond lengths are 2.82 Å. Al3+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms.
DOI: 10.17188/1310440
title: Materials Data on PaAlRu2 by Materials Project

description: PaRu2Al is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pa is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Pa–Ru bond lengths are 2.83 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Pa and four equivalent Al atoms. All Ru–Al bond lengths are 2.83 Å. Al is bonded in a body-centered cubic geometry to eight equivalent Ru atoms.
DOI: 10.17188/1310441
title: Materials Data on MgCdAu2 by Materials Project

description: MgAu2Cd 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 Au atoms. All Mg–Au bond lengths are 2.91 Å. Au is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Cd atoms. All Au–Cd bond lengths are 2.91 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Au atoms.
DOI: 10.17188/1310449
title: Materials Data on YbNdRh2 by Materials Project

description: YbNdRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Yb is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Yb–Rh bond lengths are 2.98 Å. Nd is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Nd–Rh bond lengths are 2.98 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Nd atoms.
DOI: 10.17188/1310450
title: Materials Data on MgAlPd2 by Materials Project

description: MgPd2Al 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 2.70 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Al atoms. All Pd–Al bond lengths are 2.70 Å. Al is bonded in a body-centered cubic geometry to eight equivalent Pd atoms.
DOI: 10.17188/1310451
title: Materials Data on LiCoPO4 (SG:181) by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1310452
title: Materials Data on LiFe(Si3O7)2 (SG:72) by Materials Project

description: Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations
DOI: 10.17188/1310453
title: Materials Data on MgAlRh2 by Materials Project

description: MgRh2Al 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 2.64 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Al atoms. All Rh–Al bond lengths are 2.64 Å. Al is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1310454
title: Materials Data on Dy2ZnGa by Materials Project

description: Dy2ZnGa is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Dy is bonded in a body-centered cubic geometry to four equivalent Zn and four equivalent Ga atoms. All Dy–Zn bond lengths are 3.09 Å. All Dy–Ga bond lengths are 3.09 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Dy atoms. Ga is bonded in a body-centered cubic geometry to eight equivalent Dy atoms.
DOI: 10.17188/1310455
title: Materials Data on Dy2ZnIn by Materials Project

description: Dy2ZnIn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Dy is bonded in a body-centered cubic geometry to four equivalent Zn and four equivalent In atoms. All Dy–Zn bond lengths are 3.18 Å. All Dy–In bond lengths are 3.18 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Dy atoms. In is bonded in a body-centered cubic geometry to eight equivalent Dy atoms.
DOI: 10.17188/1310456
title: Materials Data on YbNdHg2 by Materials Project

description: YbNdHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Yb is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Yb–Hg bond lengths are 3.29 Å. Nd is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Nd–Hg bond lengths are 3.29 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Nd atoms.
DOI: 10.17188/1310457
title: Materials Data on Dy2AlZn by Materials Project

description: Dy2ZnAl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Dy is bonded in a body-centered cubic geometry to four equivalent Zn and four equivalent Al atoms. All Dy–Zn bond lengths are 3.11 Å. All Dy–Al bond lengths are 3.11 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Dy atoms. Al is bonded in a body-centered cubic geometry to eight equivalent Dy atoms.
DOI: 10.17188/1310458
title: Materials Data on MgGeIr2 by Materials Project

description: MgIr2Ge 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 and six equivalent Ge atoms. All Mg–Ir bond lengths are 2.66 Å. All Mg–Ge bond lengths are 3.08 Å. Ir is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Ge atoms. All Ir–Ge bond lengths are 2.66 Å. Ge is bonded in a distorted body-centered cubic geometry to six equivalent Mg and eight equivalent Ir atoms.
DOI: 10.17188/1310459
title: Materials Data on Dy2AgRu by Materials Project

description: Dy2RuAg is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Dy is bonded in a body-centered cubic geometry to four equivalent Ru and four equivalent Ag atoms. All Dy–Ru bond lengths are 3.04 Å. All Dy–Ag bond lengths are 3.04 Å. Ru is bonded in a body-centered cubic geometry to eight equivalent Dy atoms. Ag is bonded in a body-centered cubic geometry to eight equivalent Dy atoms.
DOI: 10.17188/1310460
title: Materials Data on MgGeRh2 by Materials Project

description: MgRh2Ge 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 and six equivalent Ge atoms. All Mg–Rh bond lengths are 2.65 Å. All Mg–Ge bond lengths are 3.06 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Ge atoms. All Rh–Ge bond lengths are 2.65 Å. Ge is bonded in a distorted body-centered cubic geometry to six equivalent Mg and eight equivalent Rh atoms.
DOI: 10.17188/1310461
title: Materials Data on HfBeRh2 by Materials Project

description: BeHfRh2 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 eight equivalent Rh atoms. All Be–Rh bond lengths are 2.66 Å. Hf is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Hf–Rh bond lengths are 2.66 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Be and four equivalent Hf atoms.
DOI: 10.17188/1310462
title: Materials Data on HfCdCu2 by Materials Project

description: HfCu2Cd 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 Cu atoms. All Hf–Cu bond lengths are 2.75 Å. Cu is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Cd atoms. All Cu–Cd bond lengths are 2.75 Å. Cd is bonded in a distorted body-centered cubic geometry to eight equivalent Cu atoms.
DOI: 10.17188/1310463
title: Materials Data on HfScCo2 by Materials Project

description: ScHfCo2 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 Co atoms. All Sc–Co bond lengths are 2.72 Å. Hf is bonded in a body-centered cubic geometry to eight equivalent Co atoms. All Hf–Co bond lengths are 2.72 Å. Co is bonded in a body-centered cubic geometry to four equivalent Sc and four equivalent Hf atoms.
DOI: 10.17188/1310464
title: Materials Data on HfPd5 by Materials Project

description: HfPd5 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of two HfPd5 sheets oriented in the (0, 1, 0) direction. Hf is bonded to twelve Pd atoms to form HfPd12 cuboctahedra that share corners with four equivalent HfPd12 cuboctahedra, faces with four equivalent HfPd12 cuboctahedra, and faces with four equivalent PdHf4Pd8 cuboctahedra. There are a spread of Hf–Pd bond distances ranging from 2.79–2.85 Å. There are three inequivalent Pd sites. In the first Pd site, Pd is bonded in a distorted L-shaped geometry to two equivalent Hf and two equivalent Pd atoms. Both Pd–Pd bond lengths are 2.80 Å. In the second Pd site, Pd is bonded to four equivalent Hf and eight Pd atoms to form distorted PdHf4Pd8 cuboctahedra that share corners with four equivalent PdHf4Pd8 cuboctahedra, faces with four equivalent HfPd12 cuboctahedra, and faces with four equivalent PdHf4Pd8 cuboctahedra. All Pd–Pd bond lengths are 2.81 Å. In the third Pd site, Pd is bonded in a distorted L-shaped geometry to two equivalent Hf and two equivalent Pd atoms.
DOI: 10.17188/1310465
title: Materials Data on Ca2CdPb by Materials Project

description: Ca2CdPb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to four equivalent Cd and four equivalent Pb atoms. All Ca–Cd bond lengths are 3.37 Å. All Ca–Pb bond lengths are 3.37 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Ca atoms. Pb is bonded in a body-centered cubic geometry to eight equivalent Ca atoms.
DOI: 10.17188/1310466
title: Materials Data on Be3Ni by Materials Project

description: Be3Ni is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Be sites. In the first Be site, Be is bonded to eight Be and four equivalent Ni atoms to form BeBe8Ni4 cuboctahedra that share corners with twelve equivalent BeBe8Ni4 cuboctahedra, edges with eight equivalent BeBe8Ni4 cuboctahedra, edges with eight equivalent NiBe12 cuboctahedra, faces with four equivalent NiBe12 cuboctahedra, and faces with ten equivalent BeBe8Ni4 cuboctahedra. There are four shorter (2.22 Å) and four longer (2.32 Å) Be–Be bond lengths. All Be–Ni bond lengths are 2.32 Å. In the second Be site, Be is bonded in a distorted square co-planar geometry to eight equivalent Be and four equivalent Ni atoms. All Be–Ni bond lengths are 2.22 Å. Ni is bonded to twelve Be atoms to form NiBe12 cuboctahedra that share corners with four equivalent NiBe12 cuboctahedra, edges with eight equivalent NiBe12 cuboctahedra, edges with sixteen equivalent BeBe8Ni4 cuboctahedra, faces with four equivalent NiBe12 cuboctahedra, and faces with eight equivalent BeBe8Ni4 cuboctahedra.
DOI: 10.17188/1310467
title: Materials Data on CaErRh2 by Materials Project

description: CaErRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Ca–Rh bond lengths are 2.95 Å. Er is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Er–Rh bond lengths are 2.95 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Er atoms.
DOI: 10.17188/1310468
title: Materials Data on GaFeRh2 by Materials Project

description: Rh2FeGa is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Fe is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Fe–Rh bond lengths are 2.62 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Fe and four equivalent Ga atoms. All Rh–Ga bond lengths are 2.62 Å. Ga is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1310469
title: Materials Data on YbHg3 by Materials Project

description: YbHg3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Yb is bonded to twelve equivalent Hg atoms to form a mixture of face and corner-sharing YbHg12 cuboctahedra. There are six shorter (3.24 Å) and six longer (3.34 Å) Yb–Hg bond lengths. Hg is bonded in a distorted see-saw-like geometry to four equivalent Yb atoms.
DOI: 10.17188/1310470
title: Materials Data on YbTaRu2 by Materials Project

description: YbTaRu2 is Heusler structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Yb is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. There are two shorter (2.76 Å) and six longer (2.79 Å) Yb–Ru bond lengths. Ta is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. There are two shorter (2.77 Å) and six longer (2.79 Å) Ta–Ru bond lengths. Ru is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Ta atoms.
DOI: 10.17188/1310471
title: Materials Data on CaAcHg2 by Materials Project

description: CaAcHg2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Ca–Hg bond lengths are 3.42 Å. Ac is bonded in a body-centered cubic geometry to eight equivalent Hg atoms. All Ac–Hg bond lengths are 3.42 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Ac atoms.
DOI: 10.17188/1310472
title: Materials Data on HfCdRh2 by Materials Project

description: HfRh2Cd 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 2.80 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Cd atoms. All Rh–Cd bond lengths are 2.80 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1310473
title: Materials Data on LiEuTl2 by Materials Project

description: LiEuTl2 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 Tl atoms. All Li–Tl bond lengths are 3.33 Å. Eu is bonded in a body-centered cubic geometry to eight equivalent Tl atoms. All Eu–Tl bond lengths are 3.33 Å. Tl is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Eu atoms.