cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1313440
title: Materials Data on ZrSnPt by Materials Project

description: ZrPtSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Zr is bonded to four equivalent Pt and six equivalent Sn atoms to form a mixture of distorted corner and face-sharing ZrSn6Pt4 tetrahedra. All Zr–Pt bond lengths are 2.78 Å. All Zr–Sn bond lengths are 3.21 Å. Pt is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent Sn atoms. All Pt–Sn bond lengths are 2.78 Å. Sn is bonded in a 10-coordinate geometry to six equivalent Zr and four equivalent Pt atoms.
DOI: 10.17188/1313441
title: Materials Data on HfPtPb by Materials Project

description: HfPtPb is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hf is bonded to six equivalent Pt and four equivalent Pb atoms to form a mixture of distorted corner and face-sharing HfPt6Pb4 tetrahedra. All Hf–Pt bond lengths are 3.27 Å. All Hf–Pb bond lengths are 2.83 Å. Pt is bonded in a distorted q6 geometry to six equivalent Hf and four equivalent Pb atoms. All Pt–Pb bond lengths are 2.83 Å. Pb is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Pt atoms.
DOI: 10.17188/1313442
title: Materials Data on VSnPt by Materials Project

description: PtVSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. V is bonded to four equivalent Pt and six equivalent Sn atoms to form a mixture of distorted corner and face-sharing VSn6Pt4 tetrahedra. All V–Pt bond lengths are 2.67 Å. All V–Sn bond lengths are 3.09 Å. Pt is bonded in a body-centered cubic geometry to four equivalent V and four equivalent Sn atoms. All Pt–Sn bond lengths are 2.67 Å. Sn is bonded in a 4-coordinate geometry to six equivalent V and four equivalent Pt atoms.
DOI: 10.17188/1313443
title: Materials Data on VInPt by Materials Project

description: VPtIn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. V is bonded in a body-centered cubic geometry to four equivalent Pt and four equivalent In atoms. All V–Pt bond lengths are 2.69 Å. All V–In bond lengths are 2.69 Å. Pt is bonded to four equivalent V and six equivalent In atoms to form a mixture of distorted corner and face-sharing PtV4In6 tetrahedra. All Pt–In bond lengths are 3.10 Å. In is bonded in a 10-coordinate geometry to four equivalent V and six equivalent Pt atoms.
DOI: 10.17188/1313444
title: Materials Data on TiAsRh by Materials Project

description: TiRhAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ti is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent As atoms. All Ti–Rh bond lengths are 2.58 Å. All Ti–As bond lengths are 2.58 Å. Rh is bonded to four equivalent Ti atoms to form RhTi4 tetrahedra that share corners with four equivalent AsTi4 tetrahedra, corners with twelve equivalent RhTi4 tetrahedra, and edges with six equivalent AsTi4 tetrahedra. As is bonded to four equivalent Ti atoms to form distorted AsTi4 tetrahedra that share corners with four equivalent RhTi4 tetrahedra, corners with twelve equivalent AsTi4 tetrahedra, and edges with six equivalent RhTi4 tetrahedra.
DOI: 10.17188/1313445
title: Materials Data on HfAsRh by Materials Project

description: HfRhAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent As atoms. All Hf–Rh bond lengths are 2.70 Å. All Hf–As bond lengths are 2.70 Å. Rh is bonded to four equivalent Hf atoms to form RhHf4 tetrahedra that share corners with four equivalent AsHf4 tetrahedra, corners with twelve equivalent RhHf4 tetrahedra, and edges with six equivalent AsHf4 tetrahedra. As is bonded to four equivalent Hf atoms to form AsHf4 tetrahedra that share corners with four equivalent RhHf4 tetrahedra, corners with twelve equivalent AsHf4 tetrahedra, and edges with six equivalent RhHf4 tetrahedra.
DOI: 10.17188/1313446
title: Materials Data on ZrAsRh by Materials Project

description: ZrRhAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent As atoms. All Zr–Rh bond lengths are 2.72 Å. All Zr–As bond lengths are 2.72 Å. Rh is bonded to four equivalent Zr atoms to form RhZr4 tetrahedra that share corners with four equivalent AsZr4 tetrahedra, corners with twelve equivalent RhZr4 tetrahedra, and edges with six equivalent AsZr4 tetrahedra. As is bonded to four equivalent Zr atoms to form AsZr4 tetrahedra that share corners with four equivalent RhZr4 tetrahedra, corners with twelve equivalent AsZr4 tetrahedra, and edges with six equivalent RhZr4 tetrahedra.
DOI: 10.17188/1313447
title: Materials Data on HfBiRh by Materials Project

description: HfRhBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent Bi atoms. All Hf–Rh bond lengths are 2.86 Å. All Hf–Bi bond lengths are 2.86 Å. Rh is bonded to four equivalent Hf atoms to form distorted RhHf4 tetrahedra that share corners with four equivalent BiHf4 tetrahedra, corners with twelve equivalent RhHf4 tetrahedra, and edges with six equivalent BiHf4 tetrahedra. Bi is bonded to four equivalent Hf atoms to form distorted BiHf4 tetrahedra that share corners with four equivalent RhHf4 tetrahedra, corners with twelve equivalent BiHf4 tetrahedra, and edges with six equivalent RhHf4 tetrahedra.
DOI: 10.17188/1313448
title: Materials Data on TiBiRh by Materials Project

description: TiRhBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ti is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent Bi atoms. All Ti–Rh bond lengths are 2.75 Å. All Ti–Bi bond lengths are 2.75 Å. Rh is bonded to four equivalent Ti and six equivalent Bi atoms to form distorted RhTi4Bi6 tetrahedra that share corners with four equivalent BiTi4Rh6 tetrahedra, corners with six equivalent RhTi4Bi6 tetrahedra, edges with six equivalent BiTi4Rh6 tetrahedra, and faces with twelve equivalent RhTi4Bi6 tetrahedra. All Rh–Bi bond lengths are 3.17 Å. Bi is bonded to four equivalent Ti and six equivalent Rh atoms to form distorted BiTi4Rh6 tetrahedra that share corners with four equivalent RhTi4Bi6 tetrahedra, corners with six equivalent BiTi4Rh6 tetrahedra, edges with six equivalent RhTi4Bi6 tetrahedra, and faces with twelve equivalent BiTi4Rh6 tetrahedra.
DOI: 10.17188/1313449
title: Materials Data on LiCaRh by Materials Project

description: LiCaRh is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li is bonded in a distorted body-centered cubic geometry to four equivalent Ca and four equivalent Rh atoms. All Li–Ca bond lengths are 2.69 Å. All Li–Rh bond lengths are 2.69 Å. Ca is bonded in a distorted q6 geometry to four equivalent Li and six equivalent Rh atoms. All Ca–Rh bond lengths are 3.10 Å. Rh is bonded in a 4-coordinate geometry to four equivalent Li and six equivalent Ca atoms.
DOI: 10.17188/1313450
title: Materials Data on ZrBiRh by Materials Project

description: ZrRhBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent Bi atoms. All Zr–Rh bond lengths are 2.88 Å. All Zr–Bi bond lengths are 2.88 Å. Rh is bonded to four equivalent Zr atoms to form distorted RhZr4 tetrahedra that share corners with four equivalent BiZr4 tetrahedra, corners with twelve equivalent RhZr4 tetrahedra, and edges with six equivalent BiZr4 tetrahedra. Bi is bonded to four equivalent Zr atoms to form distorted BiZr4 tetrahedra that share corners with four equivalent RhZr4 tetrahedra, corners with twelve equivalent BiZr4 tetrahedra, and edges with six equivalent RhZr4 tetrahedra.
DOI: 10.17188/1313451
title: Materials Data on CrGeRh by Materials Project

description: CrRhGe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Cr is bonded in a 10-coordinate geometry to six equivalent Rh and four equivalent Ge atoms. All Cr–Rh bond lengths are 2.91 Å. All Cr–Ge bond lengths are 2.52 Å. Rh is bonded in a 10-coordinate geometry to six equivalent Cr and four equivalent Ge atoms. All Rh–Ge bond lengths are 2.52 Å. Ge is bonded in a body-centered cubic geometry to four equivalent Cr and four equivalent Rh atoms.
DOI: 10.17188/1313452
title: Materials Data on TaGeRh by Materials Project

description: TaRhGe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ta is bonded in a body-centered cubic geometry to four equivalent Rh and four equivalent Ge atoms. All Ta–Rh bond lengths are 2.64 Å. All Ta–Ge bond lengths are 2.64 Å. Rh is bonded to four equivalent Ta and six equivalent Ge atoms to form distorted RhTa4Ge6 tetrahedra that share corners with four equivalent GeTa4Rh6 tetrahedra, corners with six equivalent RhTa4Ge6 tetrahedra, edges with six equivalent GeTa4Rh6 tetrahedra, and faces with twelve equivalent RhTa4Ge6 tetrahedra. All Rh–Ge bond lengths are 3.05 Å. Ge is bonded to four equivalent Ta and six equivalent Rh atoms to form distorted GeTa4Rh6 tetrahedra that share corners with four equivalent RhTa4Ge6 tetrahedra, corners with six equivalent GeTa4Rh6 tetrahedra, edges with six equivalent RhTa4Ge6 tetrahedra, and faces with twelve equivalent GeTa4Rh6 tetrahedra.
DOI: 10.17188/1313453
title: Materials Data on NbInNi by Materials Project

description: NbNiIn is half-Heusler structured and crystallizes in the monoclinic Cm space group. The structure is three-dimensional. Nb is bonded in a body-centered cubic geometry to four equivalent Ni and four equivalent In atoms. All Nb–Ni bond lengths are 2.69 Å. All Nb–In bond lengths are 2.69 Å. Ni is bonded to four equivalent Nb and six equivalent In atoms to form distorted NiNb4In6 tetrahedra that share corners with four equivalent InNb4Ni6 tetrahedra, corners with six equivalent NiNb4In6 tetrahedra, edges with six equivalent InNb4Ni6 tetrahedra, and faces with twelve equivalent NiNb4In6 tetrahedra. There are two shorter (3.10 Å) and four longer (3.11 Å) Ni–In bond lengths. In is bonded to four equivalent Nb and six equivalent Ni atoms to form distorted InNb4Ni6 tetrahedra that share corners with four equivalent NiNb4In6 tetrahedra, corners with six equivalent InNb4Ni6 tetrahedra, edges with six equivalent NiNb4In6 tetrahedra, and faces with twelve equivalent InNb4Ni6 tetrahedra.
DOI: 10.17188/1313454
title: Materials Data on HfNiPb by Materials Project

description: HfNiPb is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hf is bonded to six equivalent Ni and four equivalent Pb atoms to form a mixture of distorted corner and face-sharing HfNi6Pb4 tetrahedra. All Hf–Ni bond lengths are 3.13 Å. All Hf–Pb bond lengths are 2.71 Å. Ni is bonded in a 4-coordinate geometry to six equivalent Hf and four equivalent Pb atoms. All Ni–Pb bond lengths are 2.71 Å. Pb is bonded in a body-centered cubic geometry to four equivalent Hf and four equivalent Ni atoms.
DOI: 10.17188/1313455
title: Materials Data on BaNaSb by Materials Project

description: NaBaSb is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Na1+ is bonded in a distorted body-centered cubic geometry to four equivalent Ba2+ and four equivalent Sb3- atoms. All Na–Ba bond lengths are 3.27 Å. All Na–Sb bond lengths are 3.27 Å. Ba2+ is bonded in a distorted q6 geometry to four equivalent Na1+ and six equivalent Sb3- atoms. All Ba–Sb bond lengths are 3.78 Å. Sb3- is bonded in a 4-coordinate geometry to four equivalent Na1+ and six equivalent Ba2+ atoms.
DOI: 10.17188/1313456
title: Materials Data on Th(FeP3)4 by Materials Project

description: ThFe4P12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Th4+ is bonded to twelve equivalent P1- atoms to form ThP12 cuboctahedra that share faces with eight equivalent FeP6 octahedra. All Th–P bond lengths are 2.99 Å. Fe2+ is bonded to six equivalent P1- atoms to form FeP6 octahedra that share corners with six equivalent FeP6 octahedra and faces with two equivalent ThP12 cuboctahedra. The corner-sharing octahedral tilt angles are 59°. All Fe–P bond lengths are 2.24 Å. P1- is bonded in a distorted bent 120 degrees geometry to one Th4+, two equivalent Fe2+, and two equivalent P1- atoms. There are one shorter (2.32 Å) and one longer (2.38 Å) P–P bond lengths.
DOI: 10.17188/1313457
title: Materials Data on SmZn2 by Materials Project

description: SmZn2 crystallizes in the orthorhombic Imma space group. The structure is three-dimensional. Sm is bonded in a 12-coordinate geometry to twelve equivalent Zn atoms. There are a spread of Sm–Zn bond distances ranging from 3.11–3.32 Å. Zn is bonded in a 10-coordinate geometry to six equivalent Sm and four equivalent Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.61–2.95 Å.
DOI: 10.17188/1313458
title: Materials Data on SrCaSi by Materials Project

description: SrCaSi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Sr2+ is bonded to four equivalent Ca2+ and four equivalent Si4- atoms to form distorted SrCa4Si4 tetrahedra that share corners with twelve equivalent SiSr4Ca6 tetrahedra, edges with twelve equivalent SrCa4Si4 tetrahedra, and faces with four equivalent SiSr4Ca6 tetrahedra. All Sr–Ca bond lengths are 3.15 Å. All Sr–Si bond lengths are 3.15 Å. Ca2+ is bonded in a 4-coordinate geometry to four equivalent Sr2+ and six equivalent Si4- atoms. All Ca–Si bond lengths are 3.64 Å. Si4- is bonded to four equivalent Sr2+ and six equivalent Ca2+ atoms to form SiSr4Ca6 tetrahedra that share corners with six equivalent SiSr4Ca6 tetrahedra, corners with twelve equivalent SrCa4Si4 tetrahedra, faces with four equivalent SrCa4Si4 tetrahedra, and faces with twelve equivalent SiSr4Ca6 tetrahedra.
DOI: 10.17188/1313459
title: Materials Data on YSeCl by Materials Project

description: YSeCl is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Y3+ is bonded to four equivalent Se2- and six equivalent Cl1- atoms to form distorted YSe4Cl6 tetrahedra that share corners with four equivalent ClY6Se4 tetrahedra, corners with six equivalent YSe4Cl6 tetrahedra, edges with six equivalent ClY6Se4 tetrahedra, and faces with twelve equivalent YSe4Cl6 tetrahedra. All Y–Se bond lengths are 2.97 Å. All Y–Cl bond lengths are 3.43 Å. Se2- is bonded in a body-centered cubic geometry to four equivalent Y3+ and four equivalent Cl1- atoms. All Se–Cl bond lengths are 2.97 Å. Cl1- is bonded to six equivalent Y3+ and four equivalent Se2- atoms to form distorted ClY6Se4 tetrahedra that share corners with four equivalent YSe4Cl6 tetrahedra, corners with six equivalent ClY6Se4 tetrahedra, edges with six equivalent YSe4Cl6 tetrahedra, and faces with twelve equivalent ClY6Se4 tetrahedra.
DOI: 10.17188/1313460
title: Materials Data on SrMgSi by Materials Project

description: MgSrSi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional and consists of four magnesium molecules and one SrSi framework. In the SrSi framework, Sr2+ is bonded to four equivalent Si4- atoms to form corner-sharing SrSi4 tetrahedra. All Sr–Si bond lengths are 3.13 Å. Si4- is bonded to four equivalent Sr2+ atoms to form corner-sharing SiSr4 tetrahedra.
DOI: 10.17188/1313461
title: Materials Data on NaYSi by Materials Project

description: NaYSi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Na1+ is bonded in a 10-coordinate geometry to four equivalent Y3+ and six equivalent Si4- atoms. All Na–Y bond lengths are 2.97 Å. All Na–Si bond lengths are 3.44 Å. Y3+ is bonded to four equivalent Na1+ and four equivalent Si4- atoms to form distorted YNa4Si4 tetrahedra that share corners with twelve equivalent SiNa6Y4 tetrahedra, edges with twelve equivalent YNa4Si4 tetrahedra, and faces with four equivalent SiNa6Y4 tetrahedra. All Y–Si bond lengths are 2.97 Å. Si4- is bonded to six equivalent Na1+ and four equivalent Y3+ atoms to form distorted SiNa6Y4 tetrahedra that share corners with six equivalent SiNa6Y4 tetrahedra, corners with twelve equivalent YNa4Si4 tetrahedra, faces with four equivalent YNa4Si4 tetrahedra, and faces with twelve equivalent SiNa6Y4 tetrahedra.
DOI: 10.17188/1313462
title: Materials Data on YMgTl by Materials Project

description: MgYTl is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Mg is bonded to four equivalent Y atoms to form MgY4 tetrahedra that share corners with four equivalent TlY4 tetrahedra, corners with twelve equivalent MgY4 tetrahedra, and edges with six equivalent TlY4 tetrahedra. All Mg–Y bond lengths are 3.13 Å. Y is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Tl atoms. All Y–Tl bond lengths are 3.13 Å. Tl is bonded to four equivalent Y atoms to form TlY4 tetrahedra that share corners with four equivalent MgY4 tetrahedra, corners with twelve equivalent TlY4 tetrahedra, and edges with six equivalent MgY4 tetrahedra.
DOI: 10.17188/1313463
title: Materials Data on BaSrSn by Materials Project

description: BaSrSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ba is bonded in a distorted q6 geometry to four equivalent Sr and six equivalent Sn atoms. All Ba–Sr bond lengths are 3.45 Å. All Ba–Sn bond lengths are 3.98 Å. Sr is bonded in a body-centered cubic geometry to four equivalent Ba and four equivalent Sn atoms. All Sr–Sn bond lengths are 3.45 Å. Sn is bonded in a 4-coordinate geometry to six equivalent Ba and four equivalent Sr atoms.
DOI: 10.17188/1313464
title: Materials Data on LaMgTl by Materials Project

description: MgLaTl is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Mg is bonded in a body-centered cubic geometry to four equivalent La and four equivalent Tl atoms. All Mg–La bond lengths are 3.11 Å. All Mg–Tl bond lengths are 3.11 Å. La is bonded in a 10-coordinate geometry to four equivalent Mg and six equivalent Tl atoms. All La–Tl bond lengths are 3.59 Å. Tl is bonded in a 4-coordinate geometry to four equivalent Mg and six equivalent La atoms.
DOI: 10.17188/1313465
title: Materials Data on NaYSn by Materials Project

description: NaYSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Na is bonded in a 10-coordinate geometry to four equivalent Y and six equivalent Sn atoms. All Na–Y bond lengths are 3.15 Å. All Na–Sn bond lengths are 3.64 Å. Y is bonded in a body-centered cubic geometry to four equivalent Na and four equivalent Sn atoms. All Y–Sn bond lengths are 3.15 Å. Sn is bonded in a 4-coordinate geometry to six equivalent Na and four equivalent Y atoms.
DOI: 10.17188/1313466
title: Materials Data on SrCaSn by Materials Project

description: SrCaSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Sr is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Sn atoms. All Sr–Ca bond lengths are 3.33 Å. All Sr–Sn bond lengths are 3.33 Å. Ca is bonded in a 10-coordinate geometry to four equivalent Sr and six equivalent Sn atoms. All Ca–Sn bond lengths are 3.85 Å. Sn is bonded to four equivalent Sr and six equivalent Ca atoms to form a mixture of face and corner-sharing SnSr4Ca6 tetrahedra.
DOI: 10.17188/1313467
title: Materials Data on NaLiTe by Materials Project

description: NaLiTe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Na1+ is bonded to four equivalent Te2- atoms to form NaTe4 tetrahedra that share corners with twelve equivalent LiTe6 octahedra, corners with twelve equivalent NaTe4 tetrahedra, and faces with four equivalent LiTe6 octahedra. The corner-sharing octahedral tilt angles are 55°. All Na–Te bond lengths are 3.00 Å. Li1+ is bonded to six equivalent Te2- atoms to form LiTe6 octahedra that share corners with six equivalent LiTe6 octahedra, corners with twelve equivalent NaTe4 tetrahedra, edges with twelve equivalent LiTe6 octahedra, and faces with four equivalent NaTe4 tetrahedra. The corner-sharing octahedral tilt angles are 0°. All Li–Te bond lengths are 3.47 Å. Te2- is bonded to four equivalent Na1+ and six equivalent Li1+ atoms to form a mixture of distorted face and corner-sharing TeNa4Li6 tetrahedra.
DOI: 10.17188/1313468
title: Materials Data on BaNaSn by Materials Project

description: NaBaSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Na is bonded in a body-centered cubic geometry to four equivalent Ba and four equivalent Sn atoms. All Na–Ba bond lengths are 3.33 Å. All Na–Sn bond lengths are 3.33 Å. Ba is bonded in a distorted q6 geometry to four equivalent Na and six equivalent Sn atoms. All Ba–Sn bond lengths are 3.85 Å. Sn is bonded in a 4-coordinate geometry to four equivalent Na and six equivalent Ba atoms.
DOI: 10.17188/1313469
title: Materials Data on CaMgSn by Materials Project

description: CaMgSn is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ca is bonded in a 10-coordinate geometry to four equivalent Mg and six equivalent Sn atoms. All Ca–Mg bond lengths are 3.04 Å. All Ca–Sn bond lengths are 3.51 Å. Mg is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Sn atoms. All Mg–Sn bond lengths are 3.04 Å. Sn is bonded in a 4-coordinate geometry to six equivalent Ca and four equivalent Mg atoms.
DOI: 10.17188/1313470
title: Materials Data on LiAgTe by Materials Project

description: LiAgTe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li1+ is bonded in a body-centered cubic geometry to four equivalent Ag1+ and four equivalent Te2- atoms. All Li–Ag bond lengths are 2.77 Å. All Li–Te bond lengths are 2.77 Å. Ag1+ is bonded to four equivalent Li1+ atoms to form distorted AgLi4 tetrahedra that share corners with four equivalent TeLi4 tetrahedra, corners with twelve equivalent AgLi4 tetrahedra, and edges with six equivalent TeLi4 tetrahedra. Te2- is bonded to four equivalent Li1+ atoms to form TeLi4 tetrahedra that share corners with four equivalent AgLi4 tetrahedra, corners with twelve equivalent TeLi4 tetrahedra, and edges with six equivalent AgLi4 tetrahedra.
DOI: 10.17188/1313471
title: Materials Data on LiScSi by Materials Project

description: LiScSi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional and consists of four lithium molecules and one ScSi framework. In the ScSi framework, Sc3+ is bonded to four equivalent Si4- atoms to form corner-sharing ScSi4 tetrahedra. All Sc–Si bond lengths are 2.74 Å. Si4- is bonded to four equivalent Sc3+ atoms to form corner-sharing SiSc4 tetrahedra.