cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1316196
title: Materials Data on Sm3Tm by Materials Project

description: TmSm3 is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Tm is bonded to twelve equivalent Sm atoms to form TmSm12 cuboctahedra that share corners with six equivalent TmSm12 cuboctahedra, corners with twelve equivalent SmSm8Tm4 cuboctahedra, edges with eighteen equivalent SmSm8Tm4 cuboctahedra, faces with eight equivalent TmSm12 cuboctahedra, and faces with twelve equivalent SmSm8Tm4 cuboctahedra. There are six shorter (3.57 Å) and six longer (3.64 Å) Tm–Sm bond lengths. Sm is bonded to four equivalent Tm and eight equivalent Sm atoms to form SmSm8Tm4 cuboctahedra that share corners with four equivalent TmSm12 cuboctahedra, corners with fourteen equivalent SmSm8Tm4 cuboctahedra, edges with six equivalent TmSm12 cuboctahedra, edges with twelve equivalent SmSm8Tm4 cuboctahedra, faces with four equivalent TmSm12 cuboctahedra, and faces with sixteen equivalent SmSm8Tm4 cuboctahedra. There are a spread of Sm–Sm bond distances ranging from 3.57–3.65 Å.
DOI: 10.17188/1316197
title: Materials Data on Sm3Sb4Au3 by Materials Project

description: Sm3Au3Sb4 crystallizes in the cubic I-43d space group. The structure is three-dimensional. Sm3+ is bonded in a 12-coordinate geometry to four equivalent Au1- and eight equivalent Sb+1.50- atoms. All Sm–Au bond lengths are 3.08 Å. There are four shorter (3.42 Å) and four longer (3.54 Å) Sm–Sb bond lengths. Au1- is bonded in a 8-coordinate geometry to four equivalent Sm3+ and four equivalent Sb+1.50- atoms. All Au–Sb bond lengths are 2.84 Å. Sb+1.50- is bonded in a 3-coordinate geometry to six equivalent Sm3+ and three equivalent Au1- atoms.
DOI: 10.17188/1316198
title: Materials Data on VPd3 by Materials Project

description: Pd3V is Uranium Silicide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. V is bonded to twelve equivalent Pd atoms to form VPd12 cuboctahedra that share corners with six equivalent VPd12 cuboctahedra, corners with twelve equivalent PdV4Pd8 cuboctahedra, edges with eighteen equivalent PdV4Pd8 cuboctahedra, faces with eight equivalent VPd12 cuboctahedra, and faces with twelve equivalent PdV4Pd8 cuboctahedra. There are six shorter (2.74 Å) and six longer (2.76 Å) V–Pd bond lengths. Pd is bonded to four equivalent V and eight equivalent Pd atoms to form distorted PdV4Pd8 cuboctahedra that share corners with four equivalent VPd12 cuboctahedra, corners with fourteen equivalent PdV4Pd8 cuboctahedra, edges with six equivalent VPd12 cuboctahedra, edges with twelve equivalent PdV4Pd8 cuboctahedra, faces with four equivalent VPd12 cuboctahedra, and faces with sixteen equivalent PdV4Pd8 cuboctahedra. There are a spread of Pd–Pd bond distances ranging from 2.72–2.81 Å.
DOI: 10.17188/1316199
title: Materials Data on AcYbGa2 by Materials Project

description: AcYbGa2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ac is bonded in a body-centered cubic geometry to eight equivalent Ga atoms. All Ac–Ga bond lengths are 3.30 Å. Yb is bonded in a body-centered cubic geometry to eight equivalent Ga atoms. All Yb–Ga bond lengths are 3.30 Å. Ga is bonded in a body-centered cubic geometry to four equivalent Ac and four equivalent Yb atoms.
DOI: 10.17188/1316200
title: Materials Data on YbPu3 by Materials Project

description: Pu3Yb is beta Cu3Ti-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Pu sites. In the first Pu site, Pu is bonded to eight Pu and four equivalent Yb atoms to form PuYb4Pu8 cuboctahedra that share corners with twelve equivalent PuYb4Pu8 cuboctahedra, edges with eight equivalent YbPu12 cuboctahedra, edges with sixteen PuYb4Pu8 cuboctahedra, faces with four equivalent YbPu12 cuboctahedra, and faces with fourteen PuYb4Pu8 cuboctahedra. There are four shorter (3.43 Å) and four longer (3.46 Å) Pu–Pu bond lengths. All Pu–Yb bond lengths are 3.46 Å. In the second Pu site, Pu is bonded to eight equivalent Pu and four equivalent Yb atoms to form PuYb4Pu8 cuboctahedra that share corners with four equivalent PuYb4Pu8 cuboctahedra, corners with eight equivalent YbPu12 cuboctahedra, edges with twenty-four PuYb4Pu8 cuboctahedra, faces with six equivalent YbPu12 cuboctahedra, and faces with twelve PuYb4Pu8 cuboctahedra. All Pu–Yb bond lengths are 3.43 Å. Yb is bonded to twelve Pu atoms to form YbPu12 cuboctahedra that share corners with four equivalent YbPu12 cuboctahedra, corners with eight equivalent PuYb4Pu8 cuboctahedra, edges with eight equivalent YbPu12 cuboctahedra, edges with sixteen equivalent PuYb4Pu8 cuboctahedra, faces with four equivalent YbPu12 cuboctahedra, and faces with fourteen PuYb4Pu8 cuboctahedra.
DOI: 10.17188/1316201
title: Materials Data on Cs3Yb by Materials Project

description: Cs3Yb crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Cs is bonded to eight equivalent Cs and four equivalent Yb atoms to form distorted CsCs8Yb4 cuboctahedra that share corners with four equivalent YbCs12 cuboctahedra, corners with fourteen equivalent CsCs8Yb4 cuboctahedra, edges with six equivalent YbCs12 cuboctahedra, edges with twelve equivalent CsCs8Yb4 cuboctahedra, faces with four equivalent YbCs12 cuboctahedra, and faces with sixteen equivalent CsCs8Yb4 cuboctahedra. There are a spread of Cs–Cs bond distances ranging from 4.85–5.28 Å. There are two shorter (4.94 Å) and two longer (5.07 Å) Cs–Yb bond lengths. Yb is bonded to twelve equivalent Cs atoms to form distorted YbCs12 cuboctahedra that share corners with six equivalent YbCs12 cuboctahedra, corners with twelve equivalent CsCs8Yb4 cuboctahedra, edges with eighteen equivalent CsCs8Yb4 cuboctahedra, faces with eight equivalent YbCs12 cuboctahedra, and faces with twelve equivalent CsCs8Yb4 cuboctahedra.
DOI: 10.17188/1316202
title: Materials Data on YbAu3 by Materials Project

description: YbAu3 is Uranium Silicide-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Yb3+ is bonded to twelve equivalent Au1- atoms to form a mixture of corner and face-sharing YbAu12 cuboctahedra. There are six shorter (3.04 Å) and six longer (3.07 Å) Yb–Au bond lengths. Au1- is bonded in a distorted see-saw-like geometry to four equivalent Yb3+ atoms.
DOI: 10.17188/1316203
title: Materials Data on BaCaYb2 by Materials Project

description: BaCaYb2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ba is bonded in a body-centered cubic geometry to eight equivalent Yb atoms. All Ba–Yb bond lengths are 3.89 Å. Ca is bonded in a distorted body-centered cubic geometry to eight equivalent Yb atoms. All Ca–Yb bond lengths are 3.89 Å. Yb is bonded in a body-centered cubic geometry to four equivalent Ba and four equivalent Ca atoms.
DOI: 10.17188/1316204
title: Materials Data on YbThPt2 by Materials Project

description: ThYbPt2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Th is bonded in a body-centered cubic geometry to eight equivalent Pt atoms. All Th–Pt bond lengths are 3.07 Å. Yb is bonded in a body-centered cubic geometry to eight equivalent Pt atoms. All Yb–Pt bond lengths are 3.07 Å. Pt is bonded in a body-centered cubic geometry to four equivalent Th and four equivalent Yb atoms.
DOI: 10.17188/1316205
title: Materials Data on YbSm3 by Materials Project

description: YbSm3 is alpha La-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Yb is bonded to twelve Sm atoms to form YbSm12 cuboctahedra that share corners with four equivalent YbSm12 cuboctahedra, corners with eight equivalent SmYb4Sm8 cuboctahedra, edges with eight equivalent YbSm12 cuboctahedra, edges with sixteen equivalent SmYb4Sm8 cuboctahedra, faces with four equivalent YbSm12 cuboctahedra, and faces with fourteen SmYb4Sm8 cuboctahedra. There are four shorter (3.65 Å) and eight longer (3.66 Å) Yb–Sm bond lengths. There are two inequivalent Sm sites. In the first Sm site, Sm is bonded to four equivalent Yb and eight Sm atoms to form SmYb4Sm8 cuboctahedra that share corners with twelve equivalent SmYb4Sm8 cuboctahedra, edges with eight equivalent YbSm12 cuboctahedra, edges with sixteen SmYb4Sm8 cuboctahedra, faces with four equivalent YbSm12 cuboctahedra, and faces with fourteen SmYb4Sm8 cuboctahedra. There are four shorter (3.65 Å) and four longer (3.66 Å) Sm–Sm bond lengths. In the second Sm site, Sm is bonded to four equivalent Yb and eight equivalent Sm atoms to form SmYb4Sm8 cuboctahedra that share corners with four equivalent SmYb4Sm8 cuboctahedra, corners with eight equivalent YbSm12 cuboctahedra, edges with twenty-four SmYb4Sm8 cuboctahedra, faces with six equivalent YbSm12 cuboctahedra, and faces with twelve SmYb4Sm8 cuboctahedra.
DOI: 10.17188/1316206
title: Materials Data on Yb2AgPd by Materials Project

description: Yb2PdAg 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 Pd and four equivalent Ag atoms. All Yb–Pd bond lengths are 3.09 Å. All Yb–Ag bond lengths are 3.09 Å. Pd is bonded in a body-centered cubic geometry to eight equivalent Yb atoms. Ag is bonded in a body-centered cubic geometry to eight equivalent Yb atoms.
DOI: 10.17188/1316207
title: Materials Data on YbPr3 by Materials Project

description: YbPr3 is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Yb is bonded to twelve equivalent Pr atoms to form YbPr12 cuboctahedra that share corners with twelve equivalent YbPr12 cuboctahedra, edges with twenty-four equivalent PrYb4Pr8 cuboctahedra, faces with six equivalent YbPr12 cuboctahedra, and faces with twelve equivalent PrYb4Pr8 cuboctahedra. All Yb–Pr bond lengths are 3.71 Å. Pr is bonded to four equivalent Yb and eight equivalent Pr atoms to form PrYb4Pr8 cuboctahedra that share corners with twelve equivalent PrYb4Pr8 cuboctahedra, edges with eight equivalent YbPr12 cuboctahedra, edges with sixteen equivalent PrYb4Pr8 cuboctahedra, faces with four equivalent YbPr12 cuboctahedra, and faces with fourteen equivalent PrYb4Pr8 cuboctahedra. All Pr–Pr bond lengths are 3.71 Å.
DOI: 10.17188/1316208
title: Materials Data on SmGa2Co by Materials Project

description: SmCoGa2 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Sm is bonded in a 8-coordinate geometry to four equivalent Co and ten Ga atoms. All Sm–Co bond lengths are 3.15 Å. There are a spread of Sm–Ga bond distances ranging from 3.13–3.35 Å. Co is bonded in a 10-coordinate geometry to four equivalent Sm, one Co, and five Ga atoms. The Co–Co bond length is 2.61 Å. There are a spread of Co–Ga bond distances ranging from 2.40–2.44 Å. There are three inequivalent Ga sites. In the first Ga site, Ga is bonded in a 12-coordinate geometry to four equivalent Sm, four equivalent Co, and four equivalent Ga atoms. All Ga–Ga bond lengths are 2.90 Å. In the second Ga site, Ga is bonded in a 12-coordinate geometry to four equivalent Sm, four equivalent Co, and four equivalent Ga atoms. In the third Ga site, Ga is bonded in a 1-coordinate geometry to six equivalent Sm, one Co, and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.55 Å.
DOI: 10.17188/1316209
title: Materials Data on AcYbRh2 by Materials Project

description: AcYbRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ac is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Ac–Rh bond lengths are 3.07 Å. Yb is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Yb–Rh bond lengths are 3.07 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Ac and four equivalent Yb atoms.
DOI: 10.17188/1316210
title: Materials Data on Yb3Os by Materials Project

description: Yb3Os is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded to four equivalent Yb and four equivalent Os atoms to form a mixture of distorted corner, edge, and face-sharing YbYb4Os4 tetrahedra. All Yb–Yb bond lengths are 3.10 Å. All Yb–Os bond lengths are 3.10 Å. In the second Yb site, Yb is bonded in a 8-coordinate geometry to eight equivalent Yb and six equivalent Os atoms. All Yb–Os bond lengths are 3.58 Å. Os is bonded in a distorted body-centered cubic geometry to fourteen Yb atoms.
DOI: 10.17188/1316211
title: Materials Data on TmTh3 by Materials Project

description: Th3Tm is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Th is bonded to eight equivalent Th and four equivalent Tm atoms to form ThTm4Th8 cuboctahedra that share corners with twelve equivalent ThTm4Th8 cuboctahedra, edges with eight equivalent TmTh12 cuboctahedra, edges with sixteen equivalent ThTm4Th8 cuboctahedra, faces with four equivalent TmTh12 cuboctahedra, and faces with fourteen equivalent ThTm4Th8 cuboctahedra. All Th–Th bond lengths are 3.56 Å. All Th–Tm bond lengths are 3.56 Å. Tm is bonded to twelve equivalent Th atoms to form TmTh12 cuboctahedra that share corners with twelve equivalent TmTh12 cuboctahedra, edges with twenty-four equivalent ThTm4Th8 cuboctahedra, faces with six equivalent TmTh12 cuboctahedra, and faces with twelve equivalent ThTm4Th8 cuboctahedra.
DOI: 10.17188/1316212
title: Materials Data on Yb3Os by Materials Project

description: Yb3Os is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded to four equivalent Yb and four equivalent Os atoms to form distorted YbYb4Os4 tetrahedra that share corners with eight equivalent YbYb8Os4 cuboctahedra, corners with eight equivalent OsYb12 cuboctahedra, corners with eight equivalent YbYb4Os4 tetrahedra, edges with four equivalent YbYb8Os4 cuboctahedra, edges with four equivalent OsYb12 cuboctahedra, edges with twelve equivalent YbYb4Os4 tetrahedra, and faces with six equivalent YbYb4Os4 tetrahedra. All Yb–Yb bond lengths are 3.11 Å. All Yb–Os bond lengths are 3.11 Å. In the second Yb site, Yb is bonded to eight equivalent Yb and four equivalent Os atoms to form distorted YbYb8Os4 cuboctahedra that share corners with four equivalent YbYb8Os4 cuboctahedra, corners with eight equivalent OsYb12 cuboctahedra, corners with sixteen equivalent YbYb4Os4 tetrahedra, edges with eight equivalent YbYb8Os4 cuboctahedra, edges with eight equivalent YbYb4Os4 tetrahedra, faces with four equivalent YbYb8Os4 cuboctahedra, and faces with six equivalent OsYb12 cuboctahedra. All Yb–Os bond lengths are 3.44 Å. Os is bonded to twelve Yb atoms to form distorted OsYb12 cuboctahedra that share corners with four equivalent OsYb12 cuboctahedra, corners with eight equivalent YbYb8Os4 cuboctahedra, corners with sixteen equivalent YbYb4Os4 tetrahedra, edges with eight equivalent OsYb12 cuboctahedra, edges with eight equivalent YbYb4Os4 tetrahedra, faces with four equivalent OsYb12 cuboctahedra, and faces with six equivalent YbYb8Os4 cuboctahedra.
DOI: 10.17188/1316213
title: Materials Data on Yb3Mg by Materials Project

description: MgYb3 is alpha bismuth trifluoride 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 Yb atoms. All Mg–Yb bond lengths are 3.56 Å. There are two inequivalent Yb sites. In the first Yb site, Yb is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent Yb atoms. All Yb–Yb bond lengths are 3.56 Å. In the second Yb site, Yb is bonded in a body-centered cubic geometry to eight equivalent Yb atoms.
DOI: 10.17188/1316214
title: Materials Data on Tl3Ru by Materials Project

description: RuTl3 is beta Cu3Ti-like structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ru is bonded to twelve equivalent Tl atoms to form RuTl12 cuboctahedra that share corners with six equivalent RuTl12 cuboctahedra, corners with twelve equivalent TlTl8Ru4 cuboctahedra, edges with eighteen equivalent TlTl8Ru4 cuboctahedra, faces with eight equivalent RuTl12 cuboctahedra, and faces with twelve equivalent TlTl8Ru4 cuboctahedra. All Ru–Tl bond lengths are 3.19 Å. Tl is bonded to four equivalent Ru and eight equivalent Tl atoms to form distorted TlTl8Ru4 cuboctahedra that share corners with four equivalent RuTl12 cuboctahedra, corners with fourteen equivalent TlTl8Ru4 cuboctahedra, edges with six equivalent RuTl12 cuboctahedra, edges with twelve equivalent TlTl8Ru4 cuboctahedra, faces with four equivalent RuTl12 cuboctahedra, and faces with sixteen equivalent TlTl8Ru4 cuboctahedra. There are a spread of Tl–Tl bond distances ranging from 3.08–3.30 Å.
DOI: 10.17188/1316215
title: Materials Data on YbPrCd2 by Materials Project

description: YbPrCd2 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 Cd atoms. All Yb–Cd bond lengths are 3.33 Å. Pr is bonded in a body-centered cubic geometry to eight equivalent Cd atoms. All Pr–Cd bond lengths are 3.33 Å. Cd is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Pr atoms.
DOI: 10.17188/1316216
title: Materials Data on Yb3In by Materials Project

description: Yb3In is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Yb sites. In the first Yb site, Yb is bonded to four equivalent Yb and four equivalent In atoms to form a mixture of distorted edge, face, and corner-sharing YbYb4In4 tetrahedra. All Yb–Yb bond lengths are 3.44 Å. All Yb–In bond lengths are 3.44 Å. In the second Yb site, Yb is bonded in a 8-coordinate geometry to eight equivalent Yb and six equivalent In atoms. All Yb–In bond lengths are 3.97 Å. In is bonded in a body-centered cubic geometry to fourteen Yb atoms.
DOI: 10.17188/1316217
title: Materials Data on YbPbAu2 by Materials Project

description: YbAu2Pb is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Yb is bonded in a distorted body-centered cubic geometry to eight equivalent Au and six equivalent Pb atoms. All Yb–Au bond lengths are 3.10 Å. All Yb–Pb bond lengths are 3.58 Å. Au is bonded in a body-centered cubic geometry to four equivalent Yb and four equivalent Pb atoms. All Au–Pb bond lengths are 3.10 Å. Pb is bonded in a 8-coordinate geometry to six equivalent Yb and eight equivalent Au atoms.
DOI: 10.17188/1316218
title: Materials Data on YErMg2 by Materials Project

description: Mg2ErY 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 four equivalent Er and four equivalent Y atoms. All Mg–Er bond lengths are 3.28 Å. All Mg–Y bond lengths are 3.28 Å. Er is bonded in a body-centered cubic geometry to eight equivalent Mg atoms. Y is bonded in a body-centered cubic geometry to eight equivalent Mg atoms.
DOI: 10.17188/1316219
title: Materials Data on Rb2Yb2O5 by Materials Project

description: Rb2Yb2O5 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. there are two inequivalent Rb sites. In the first Rb site, Rb is bonded in a body-centered cubic geometry to eight equivalent O atoms. All Rb–O bond lengths are 3.00 Å. In the second Rb site, Rb is bonded to twelve O atoms to form RbO12 cuboctahedra that share corners with four equivalent RbO12 cuboctahedra, faces with four equivalent RbO12 cuboctahedra, and faces with eight equivalent YbO5 square pyramids. There are four shorter (3.12 Å) and eight longer (3.45 Å) Rb–O bond lengths. Yb is bonded to five O atoms to form distorted YbO5 square pyramids that share corners with five equivalent YbO5 square pyramids and faces with four equivalent RbO12 cuboctahedra. There are one shorter (2.20 Å) and four longer (2.26 Å) Yb–O bond lengths. There are two inequivalent O sites. In the first O site, O is bonded in a 2-coordinate geometry to four Rb and two equivalent Yb atoms. In the second O site, O is bonded to four equivalent Rb and two equivalent Yb atoms to form a mixture of distorted edge and corner-sharing ORb4Yb2 octahedra. The corner-sharing octahedral tilt angles are 0°.
DOI: 10.17188/1316220
title: Materials Data on SrAlGeH by Materials Project

description: SrAlGeH crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. Sr is bonded in a distorted trigonal planar geometry to three equivalent Ge and three equivalent H atoms. All Sr–Ge bond lengths are 3.30 Å. All Sr–H bond lengths are 2.51 Å. Al is bonded in a distorted single-bond geometry to three equivalent Ge and one H atom. All Al–Ge bond lengths are 2.52 Å. The Al–H bond length is 1.75 Å. Ge is bonded in a 3-coordinate geometry to three equivalent Sr and three equivalent Al atoms. H is bonded to three equivalent Sr and one Al atom to form distorted corner-sharing HSr3Al tetrahedra.
DOI: 10.17188/1316221
title: Materials Data on RbTbO3 by Materials Project

description: RbTbO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent TbO6 octahedra. All Rb–O bond lengths are 3.21 Å. Tb is bonded to six equivalent O atoms to form TbO6 octahedra that share corners with six equivalent TbO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Tb–O bond lengths are 2.27 Å. O is bonded in a distorted linear geometry to four equivalent Rb and two equivalent Tb atoms.
DOI: 10.17188/1316222
title: Materials Data on TbPmRh2 by Materials Project

description: TbPmRh2 is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tb is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Tb–Rh bond lengths are 3.03 Å. Pm is bonded in a body-centered cubic geometry to eight equivalent Rh atoms. All Pm–Rh bond lengths are 3.03 Å. Rh is bonded in a body-centered cubic geometry to four equivalent Tb and four equivalent Pm atoms.
DOI: 10.17188/1316223
title: Materials Data on TbAg3 by Materials Project

description: Ag3Tb is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Tb is bonded to twelve Ag atoms to form TbAg12 cuboctahedra that share corners with four equivalent TbAg12 cuboctahedra, corners with eight equivalent AgTb4Ag8 cuboctahedra, edges with eight equivalent TbAg12 cuboctahedra, faces with four equivalent TbAg12 cuboctahedra, and faces with six equivalent AgTb4Ag8 cuboctahedra. There are eight shorter (3.04 Å) and four longer (3.21 Å) Tb–Ag bond lengths. There are two inequivalent Ag sites. In the first Ag site, Ag is bonded in a 12-coordinate geometry to four equivalent Tb and four equivalent Ag atoms. All Ag–Ag bond lengths are 3.04 Å. In the second Ag site, Ag is bonded to four equivalent Tb and eight equivalent Ag atoms to form AgTb4Ag8 cuboctahedra that share corners with four equivalent AgTb4Ag8 cuboctahedra, corners with eight equivalent TbAg12 cuboctahedra, edges with eight equivalent AgTb4Ag8 cuboctahedra, faces with four equivalent AgTb4Ag8 cuboctahedra, and faces with six equivalent TbAg12 cuboctahedra.