cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1315729
title: Materials Data on NpCdAu2 by Materials Project

description: NpAu2Cd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Np is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Np–Au bond lengths are 3.07 Å. Au is bonded in a body-centered cubic geometry to four equivalent Np and four equivalent Cd atoms. All Au–Cd bond lengths are 3.07 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Au atoms.
DOI: 10.17188/1315730
title: Materials Data on Yb2ZnRh by Materials Project

description: Yb2RhZn 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 four equivalent Rh and four equivalent Zn atoms. All Yb–Rh bond lengths are 2.99 Å. All Yb–Zn bond lengths are 2.99 Å. Rh is bonded in a body-centered cubic geometry to eight equivalent Yb atoms. Zn is bonded in a body-centered cubic geometry to eight equivalent Yb atoms.
DOI: 10.17188/1315731
title: Materials Data on Yb2ZnPb by Materials Project

description: Yb2ZnPb 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 four equivalent Zn and four equivalent Pb atoms. All Yb–Zn bond lengths are 3.27 Å. All Yb–Pb bond lengths are 3.27 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Yb atoms. Pb is bonded in a body-centered cubic geometry to eight equivalent Yb atoms.
DOI: 10.17188/1315732
title: Materials Data on Ta2CrRu by Materials Project

description: Ta2CrRu is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ta is bonded in a body-centered cubic geometry to four equivalent Cr and four equivalent Ru atoms. All Ta–Cr bond lengths are 2.72 Å. All Ta–Ru bond lengths are 2.72 Å. Cr is bonded in a distorted body-centered cubic geometry to eight equivalent Ta and six equivalent Ru atoms. All Cr–Ru bond lengths are 3.14 Å. Ru is bonded in a body-centered cubic geometry to eight equivalent Ta and six equivalent Cr atoms.
DOI: 10.17188/1315733
title: Materials Data on NbCo3 by Materials Project

description: NbCo3 is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Nb is bonded to twelve Co atoms to form NbCo12 cuboctahedra that share corners with six equivalent NbCo12 cuboctahedra, corners with twelve CoNb4Co8 cuboctahedra, edges with eighteen CoNb4Co8 cuboctahedra, faces with eight equivalent NbCo12 cuboctahedra, and faces with twelve CoNb4Co8 cuboctahedra. There are six shorter (2.60 Å) and six longer (2.62 Å) Nb–Co bond lengths. There are three inequivalent Co sites. In the first Co site, Co is bonded to four equivalent Nb and eight Co atoms to form distorted CoNb4Co8 cuboctahedra that share corners with four equivalent NbCo12 cuboctahedra, corners with fourteen CoNb4Co8 cuboctahedra, edges with six equivalent NbCo12 cuboctahedra, edges with twelve CoNb4Co8 cuboctahedra, faces with four equivalent NbCo12 cuboctahedra, and faces with sixteen CoNb4Co8 cuboctahedra. There are a spread of Co–Co bond distances ranging from 2.46–2.74 Å. In the second Co site, Co is bonded to four equivalent Nb and eight Co atoms to form distorted CoNb4Co8 cuboctahedra that share corners with four equivalent NbCo12 cuboctahedra, corners with fourteen CoNb4Co8 cuboctahedra, edges with six equivalent NbCo12 cuboctahedra, edges with twelve CoNb4Co8 cuboctahedra, faces with four equivalent NbCo12 cuboctahedra, and faces with sixteen CoNb4Co8 cuboctahedra. There are a spread of Co–Co bond distances ranging from 2.46–2.74 Å. In the third Co site, Co is bonded to four equivalent Nb and eight Co atoms to form distorted CoNb4Co8 cuboctahedra that share corners with four equivalent NbCo12 cuboctahedra, corners with fourteen CoNb4Co8 cuboctahedra, edges with six equivalent NbCo12 cuboctahedra, edges with twelve CoNb4Co8 cuboctahedra, faces with four equivalent NbCo12 cuboctahedra, and faces with sixteen CoNb4Co8 cuboctahedra. There are one shorter (2.46 Å) and one longer (2.74 Å) Co–Co bond lengths.
DOI: 10.17188/1315734
title: Materials Data on YbAl2Cu by Materials Project

description: YbCuAl2 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a 6-coordinate geometry to six equivalent Cu and twelve equivalent Al atoms. All Yb–Cu bond lengths are 3.15 Å. All Yb–Al bond lengths are 3.41 Å. In the second Yb site, Yb is bonded in a 12-coordinate geometry to three equivalent Cu and nine equivalent Al atoms. All Yb–Cu bond lengths are 3.20 Å. All Yb–Al bond lengths are 3.21 Å. There are two inequivalent Cu sites. In the first Cu site, Cu is bonded in a 9-coordinate geometry to three equivalent Yb and six equivalent Al atoms. There are three shorter (2.55 Å) and three longer (2.60 Å) Cu–Al bond lengths. In the second Cu site, Cu is bonded to six equivalent Yb and six equivalent Al atoms to form CuYb6Al6 cuboctahedra that share corners with twelve equivalent AlYb5Al4Cu3 cuboctahedra, edges with six equivalent CuYb6Al6 cuboctahedra, and faces with eighteen equivalent AlYb5Al4Cu3 cuboctahedra. All Cu–Al bond lengths are 2.74 Å. Al is bonded to five Yb, three Cu, and four equivalent Al atoms to form distorted AlYb5Al4Cu3 cuboctahedra that share corners with two equivalent CuYb6Al6 cuboctahedra, corners with fifteen equivalent AlYb5Al4Cu3 cuboctahedra, edges with eight equivalent AlYb5Al4Cu3 cuboctahedra, faces with three equivalent CuYb6Al6 cuboctahedra, and faces with eleven equivalent AlYb5Al4Cu3 cuboctahedra. There are two shorter (2.72 Å) and two longer (2.73 Å) Al–Al bond lengths.
DOI: 10.17188/1315735
title: Materials Data on MgNbRu2 by Materials Project

description: MgNbRu2 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 Ru atoms. All Mg–Ru bond lengths are 2.72 Å. Nb is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Nb–Ru bond lengths are 2.72 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Nb atoms.
DOI: 10.17188/1315736
title: Materials Data on Nb3Ru by Materials Project

description: Nb3Ru is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Nb sites. In the first Nb site, Nb is bonded to four equivalent Nb and four equivalent Ru atoms to form a mixture of distorted corner, edge, and face-sharing NbNb4Ru4 tetrahedra. All Nb–Nb bond lengths are 2.81 Å. All Nb–Ru bond lengths are 2.81 Å. In the second Nb site, Nb is bonded in a 8-coordinate geometry to eight equivalent Nb and six equivalent Ru atoms. All Nb–Ru bond lengths are 3.24 Å. Ru is bonded in a distorted body-centered cubic geometry to fourteen Nb atoms.
DOI: 10.17188/1315737
title: Materials Data on ZrAlRh2 by Materials Project

description: ZrRh2Al is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Zr–Rh bond lengths are 2.75 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent Al atoms. All Rh–Al bond lengths are 2.75 Å. Al is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1315738
title: Materials Data on ZrAlRu2 by Materials Project

description: Ru2ZrAl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Ru atoms. All Zr–Ru bond lengths are 2.73 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent Al atoms. All Ru–Al bond lengths are 2.73 Å. Al is bonded in a body-centered cubic geometry to eight equivalent Ru atoms.
DOI: 10.17188/1315739
title: Materials Data on HoZrOs2 by Materials Project

description: HoZrOs2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ho is bonded in a body-centered cubic geometry to eight equivalent Os atoms. All Ho–Os bond lengths are 2.89 Å. Zr is bonded in a body-centered cubic geometry to eight equivalent Os atoms. All Zr–Os bond lengths are 2.89 Å. Os is bonded in a body-centered cubic geometry to four equivalent Ho and four equivalent Zr atoms.
DOI: 10.17188/1315740
title: Materials Data on MgInRh2 by Materials Project

description: MgRh2In 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. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent In atoms. All Rh–In bond lengths are 2.76 Å. In is bonded in a distorted body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1315741
title: Materials Data on Ce2ZnPb by Materials Project

description: Ce2ZnPb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ce is bonded in a body-centered cubic geometry to four equivalent Zn and four equivalent Pb atoms. All Ce–Zn bond lengths are 3.30 Å. All Ce–Pb bond lengths are 3.30 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Ce atoms. Pb is bonded in a body-centered cubic geometry to eight equivalent Ce atoms.
DOI: 10.17188/1315742
title: Materials Data on LiTiPt2 by Materials Project

description: LiTiPt2 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 2.67 Å. Ti3+ is bonded in a body-centered cubic geometry to eight equivalent Pt2- atoms. All Ti–Pt bond lengths are 2.67 Å. Pt2- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Ti3+ atoms.
DOI: 10.17188/1315743
title: Materials Data on Yb2ZnGa by Materials Project

description: Yb2ZnGa 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 four equivalent Zn and four equivalent Ga atoms. All Yb–Zn bond lengths are 3.12 Å. All Yb–Ga bond lengths are 3.12 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Yb atoms. Ga is bonded in a body-centered cubic geometry to eight equivalent Yb atoms.
DOI: 10.17188/1315744
title: Materials Data on ZrGeRu2 by Materials Project

description: ZrRu2Ge is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Ru and six equivalent Ge atoms. All Zr–Ru bond lengths are 2.73 Å. All Zr–Ge bond lengths are 3.15 Å. Ru is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent Ge atoms. All Ru–Ge bond lengths are 2.73 Å. Ge is bonded in a distorted body-centered cubic geometry to six equivalent Zr and eight equivalent Ru atoms.
DOI: 10.17188/1315745
title: Materials Data on PaAgAu2 by Materials Project

description: PaAu2Ag 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 Au atoms. All Pa–Au bond lengths are 3.01 Å. Au is bonded in a body-centered cubic geometry to four equivalent Pa and four equivalent Ag atoms. All Au–Ag bond lengths are 3.01 Å. Ag is bonded in a body-centered cubic geometry to eight equivalent Au atoms.
DOI: 10.17188/1315746
title: Materials Data on Nd2ZnIr by Materials Project

description: Nd2IrZn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Nd is bonded in a body-centered cubic geometry to four equivalent Ir and four equivalent Zn atoms. All Nd–Ir bond lengths are 3.12 Å. All Nd–Zn bond lengths are 3.12 Å. Ir is bonded in a body-centered cubic geometry to eight equivalent Nd atoms. Zn is bonded in a body-centered cubic geometry to eight equivalent Nd atoms.
DOI: 10.17188/1315747
title: Materials Data on NdVGe3 by Materials Project

description: NdVGe3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Nd is bonded to twelve equivalent Ge atoms to form distorted NdGe12 cuboctahedra that share corners with six equivalent NdGe12 cuboctahedra, corners with six equivalent VGe6 octahedra, faces with eight equivalent NdGe12 cuboctahedra, and faces with six equivalent VGe6 octahedra. The corner-sharing octahedral tilt angles are 28°. There are six shorter (3.15 Å) and six longer (3.19 Å) Nd–Ge bond lengths. V is bonded to six equivalent Ge atoms to form VGe6 octahedra that share corners with six equivalent NdGe12 cuboctahedra, faces with six equivalent NdGe12 cuboctahedra, and faces with two equivalent VGe6 octahedra. All V–Ge bond lengths are 2.53 Å. Ge is bonded in a 8-coordinate geometry to four equivalent Nd, two equivalent V, and two equivalent Ge atoms. Both Ge–Ge bond lengths are 2.61 Å.
DOI: 10.17188/1315748
title: Materials Data on Ca2CdIn by Materials Project

description: Ca2CdIn 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 In atoms. All Ca–Cd bond lengths are 3.34 Å. All Ca–In bond lengths are 3.34 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Ca atoms. In is bonded in a body-centered cubic geometry to eight equivalent Ca atoms.
DOI: 10.17188/1315749
title: Materials Data on HgPd2Au by Materials Project

description: Pd2AuHg is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pd is bonded in a body-centered cubic geometry to four equivalent Au and four equivalent Hg atoms. All Pd–Au bond lengths are 2.83 Å. All Pd–Hg bond lengths are 2.83 Å. Au is bonded in a distorted body-centered cubic geometry to eight equivalent Pd atoms. Hg is bonded in a distorted body-centered cubic geometry to eight equivalent Pd atoms.
DOI: 10.17188/1315752
title: Materials Data on PaAgO3 by Materials Project

description: PaAgO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pa5+ is bonded to six equivalent O2- atoms to form PaO6 octahedra that share corners with six equivalent PaO6 octahedra and faces with eight equivalent AgO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pa–O bond lengths are 2.17 Å. Ag1+ is bonded to twelve equivalent O2- atoms to form AgO12 cuboctahedra that share corners with twelve equivalent AgO12 cuboctahedra, faces with six equivalent AgO12 cuboctahedra, and faces with eight equivalent PaO6 octahedra. All Ag–O bond lengths are 3.07 Å. O2- is bonded in a distorted linear geometry to two equivalent Pa5+ and four equivalent Ag1+ atoms.
DOI: 10.17188/1315753
title: Materials Data on ZrCdAu2 by Materials Project

description: ZrAu2Cd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Au atoms. All Zr–Au bond lengths are 2.94 Å. Au is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent Cd atoms. All Au–Cd bond lengths are 2.94 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Au atoms.
DOI: 10.17188/1315754
title: Materials Data on MgMnRh2 by Materials Project

description: MgMnRh2 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 2.66 Å. Mn is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Mn–Rh bond lengths are 2.66 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Mn atoms.
DOI: 10.17188/1315755
title: Materials Data on ZrInPd2 by Materials Project

description: Pd2ZrIn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Pd atoms. All Zr–Pd bond lengths are 2.88 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent In atoms. All Pd–In bond lengths are 2.88 Å. In is bonded in a distorted body-centered cubic geometry to eight equivalent Pd atoms.
DOI: 10.17188/1315756
title: Materials Data on NaSrAs by Materials Project

description: NaSrAs crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Na1+ is bonded to four As3- atoms to form NaAs4 tetrahedra that share corners with six equivalent SrAs5 square pyramids, corners with ten equivalent NaAs4 tetrahedra, edges with six equivalent SrAs5 square pyramids, and edges with two equivalent NaAs4 tetrahedra. There are two shorter (2.99 Å) and two longer (3.06 Å) Na–As bond lengths. Sr2+ is bonded to five As3- atoms to form SrAs5 square pyramids that share corners with ten equivalent SrAs5 square pyramids, corners with six equivalent NaAs4 tetrahedra, edges with six equivalent SrAs5 square pyramids, and edges with six equivalent NaAs4 tetrahedra. There are one shorter (3.27 Å) and four longer (3.31 Å) Sr–As bond lengths. There are two inequivalent As3- sites. In the first As3- site, As3- is bonded in a 9-coordinate geometry to three equivalent Na1+ and six equivalent Sr2+ atoms. In the second As3- site, As3- is bonded in a 9-coordinate geometry to six equivalent Na1+ and three equivalent Sr2+ atoms.
DOI: 10.17188/1315757
title: Materials Data on ZrNbTc2 by Materials Project

description: ZrNbTc2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr4+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms. All Zr–Tc bond lengths are 2.81 Å. Nb2+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms. All Nb–Tc bond lengths are 2.81 Å. Tc3- is bonded in a body-centered cubic geometry to four equivalent Zr4+ and four equivalent Nb2+ atoms.
DOI: 10.17188/1315758
title: Materials Data on ZrCdRh2 by Materials Project

description: ZrRh2Cd is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Zr–Rh bond lengths are 2.82 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent Cd atoms. All Rh–Cd bond lengths are 2.82 Å. Cd is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1315759
title: Materials Data on ErZnRh2 by Materials Project

description: ErRh2Zn is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Er is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Er–Rh bond lengths are 2.79 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Er and four equivalent Zn atoms. All Rh–Zn bond lengths are 2.79 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1315760
title: Materials Data on LiNd2Ru by Materials Project

description: LiNd2Ru 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 Nd atoms. All Li–Nd bond lengths are 3.10 Å. Nd is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Ru atoms. All Nd–Ru bond lengths are 3.10 Å. Ru is bonded in a body-centered cubic geometry to eight equivalent Nd atoms.
DOI: 10.17188/1315761
title: Materials Data on CaBiPd2 by Materials Project

description: CaPd2Bi is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ca is bonded in a distorted body-centered cubic geometry to eight equivalent Pd and six equivalent Bi atoms. All Ca–Pd bond lengths are 3.01 Å. All Ca–Bi bond lengths are 3.48 Å. Pd is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Bi atoms. All Pd–Bi bond lengths are 3.01 Å. Bi is bonded in a 8-coordinate geometry to six equivalent Ca and eight equivalent Pd atoms.
DOI: 10.17188/1315762
title: Materials Data on Hf2TcOs by Materials Project

description: Hf2TcOs 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 Tc and four equivalent Os atoms. All Hf–Tc bond lengths are 2.82 Å. All Hf–Os bond lengths are 2.82 Å. Tc is bonded in a body-centered cubic geometry to eight equivalent Hf atoms. Os is bonded in a body-centered cubic geometry to eight equivalent Hf atoms.
DOI: 10.17188/1315763
title: Materials Data on ZrInRh2 by Materials Project

description: ZrRh2In is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Zr–Rh bond lengths are 2.83 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Zr and four equivalent In atoms. All Rh–In bond lengths are 2.83 Å. In is bonded in a distorted body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1315764
title: Materials Data on ZrTc2W by Materials Project

description: ZrWTc2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Zr4+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms. All Zr–Tc bond lengths are 2.78 Å. W2+ is bonded in a body-centered cubic geometry to eight equivalent Tc3- atoms. All W–Tc bond lengths are 2.78 Å. Tc3- is bonded in a body-centered cubic geometry to four equivalent Zr4+ and four equivalent W2+ atoms.
DOI: 10.17188/1315765
title: Materials Data on Pm2ZnGa by Materials Project

description: Pm2ZnGa is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Pm is bonded in a body-centered cubic geometry to four equivalent Zn and four equivalent Ga atoms. All Pm–Zn bond lengths are 3.18 Å. All Pm–Ga bond lengths are 3.18 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Pm atoms. Ga is bonded in a body-centered cubic geometry to eight equivalent Pm atoms.
DOI: 10.17188/1315766
title: Materials Data on MgZnRh2 by Materials Project

description: MgRh2Zn 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 2.66 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Mg and four equivalent Zn atoms. All Rh–Zn bond lengths are 2.66 Å. Zn is bonded in a body-centered cubic geometry to eight equivalent Rh atoms.
DOI: 10.17188/1315767
title: Materials Data on Nd2MgGe2 by Materials Project

description: MgNd2Ge2 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Mg is bonded in a square co-planar geometry to four equivalent Ge atoms. All Mg–Ge bond lengths are 2.97 Å. Nd is bonded in a 6-coordinate geometry to six equivalent Ge atoms. There are two shorter (3.05 Å) and four longer (3.17 Å) Nd–Ge bond lengths. Ge is bonded in a 9-coordinate geometry to two equivalent Mg, six equivalent Nd, and one Ge atom. The Ge–Ge bond length is 2.57 Å.