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Materials Data on RbOsN2 by Materials Project

RbOsN2 crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight N3- atoms. There are a spread of Rb–N bond distances ranging from 3.21–3.37 Å. In the second Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to seven N3- atoms. There are a spread of Rb–N bond distances ranging from 3.07–3.44 Å. There are two inequivalent Os5+ sites. In the first Os5+ site, Os5+ is bonded to four N3- atoms to form corner-sharing OsN4 tetrahedra. There is two shorter (1.87 Å) and two longer (1.88 Å) Os–N bond length. In the second Os5+ site, Os5+ is bonded to four N3- atoms to form corner-sharing OsN4 tetrahedra. There are a spread of Os–N bond distances ranging from 1.87–1.89 Å. There are four inequivalent N3- sites. In the first N3- site, N3- is bonded in a 2-coordinate geometry to three Rb1+ and two equivalent Os5+ atoms. In the second N3- site, N3- is bonded in a distorted linear geometry to four Rb1+ and two Os5+ atoms. In the third N3- site, N3- is bonded in a distorted linear geometry to four Rb1+ and two Os5+ atoms. In the fourth N3- site, N3- is bonded in a distorted linear geometry to four Rb1+ and two equivalent Os5+ atoms.

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Materials Data on Rb3DyF6 by Materials Project

Rb3DyF6 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to four equivalent F1- atoms. All Rb–F bond lengths are 2.79 Å. In the second Rb1+ site, Rb1+ is bonded in a linear geometry to two equivalent F1- atoms. Both Rb–F bond lengths are 2.59 Å. Dy3+ is bonded in an octahedral geometry to six F1- atoms. There are four shorter (2.18 Å) and two longer (2.20 Å) Dy–F bond lengths. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Rb1+ and one Dy3+ atom. In the second F1- site, F1- is bonded in a linear geometry to one Rb1+ and one Dy3+ atom.

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Materials Data on KRb2W(OF)3 by Materials Project

Rb2KWO3F3 crystallizes in the orthorhombic Fmm2 space group. The structure is three-dimensional. Rb1+ is bonded to six O2- and six F1- atoms to form distorted RbO6F6 cuboctahedra that share corners with twelve equivalent RbO6F6 cuboctahedra, faces with six equivalent RbO6F6 cuboctahedra, faces with four equivalent KO3F3 octahedra, and faces with four equivalent WO3F3 octahedra. There are a spread of Rb–O bond distances ranging from 3.12–3.44 Å. There are a spread of Rb–F bond distances ranging from 3.20–3.29 Å. K1+ is bonded to three O2- and three F1- atoms to form KO3F3 octahedra that share corners with six equivalent WO3F3 octahedra and faces with eight equivalent RbO6F6 cuboctahedra. The corner-sharing octahedra tilt angles range from 0–13°. There are one shorter (2.67 Å) and two longer (2.69 Å) K–O bond lengths. There are two shorter (2.56 Å) and one longer (2.58 Å) K–F bond lengths. W6+ is bonded to three O2- and three F1- atoms to form WO3F3 octahedra that share corners with six equivalent KO3F3 octahedra and faces with eight equivalent RbO6F6 cuboctahedra. The corner-sharing octahedra tilt angles range from 0–13°. There is one shorter (1.81 Å) and two longer (1.86 Å) W–O bond length. There are two shorter (2.01 Å) and one longer (2.17 Å) W–F bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to four equivalent Rb1+, one K1+, and one W6+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to four equivalent Rb1+, one K1+, and one W6+ atom. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted linear geometry to four equivalent Rb1+, one K1+, and one W6+ atom. In the second F1- site, F1- is bonded in a distorted linear geometry to four equivalent Rb1+, one K1+, and one W6+ atom.

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Materials Data on Rb2InGe4As7 by Materials Project

Rb2InGe4As7 crystallizes in the monoclinic Cm space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 9-coordinate geometry to nine As3- atoms. There are a spread of Rb–As bond distances ranging from 3.77–3.96 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight As3- atoms. There are a spread of Rb–As bond distances ranging from 3.58–3.94 Å. In3+ is bonded in a trigonal non-coplanar geometry to three As3- atoms. There are one shorter (2.69 Å) and two longer (2.72 Å) In–As bond lengths. There are four inequivalent Ge4+ sites. In the first Ge4+ site, Ge4+ is bonded to four As3- atoms to form corner-sharing GeAs4 tetrahedra. There are a spread of Ge–As bond distances ranging from 2.50–2.55 Å. In the second Ge4+ site, Ge4+ is bonded to four As3- atoms to form corner-sharing GeAs4 tetrahedra. There are a spread of Ge–As bond distances ranging from 2.48–2.55 Å. In the third Ge4+ site, Ge4+ is bonded in a bent 120 degrees geometry to two equivalent As3- atoms. Both Ge–As bond lengths are 2.49 Å. In the fourth Ge4+ site, Ge4+ is bonded to four As3- atoms to form corner-sharing GeAs4 tetrahedra. There are a spread of Ge–As bond distances ranging from 2.47–2.58 Å. There are seven inequivalent As3- sites. In the first As3- site, As3- is bonded in a 5-coordinate geometry to two equivalent Rb1+ and three Ge4+ atoms. In the second As3- site, As3- is bonded to two equivalent Rb1+, one In3+, and two equivalent Ge4+ atoms to form distorted edge-sharing AsRb2InGe2 square pyramids. In the third As3- site, As3- is bonded in a 5-coordinate geometry to two equivalent Rb1+, two equivalent In3+, and one Ge4+ atom. In the fourth As3- site, As3- is bonded in a 5-coordinate geometry to two equivalent Rb1+ and three Ge4+ atoms. In the fifth As3- site, As3- is bonded in a 3-coordinate geometry to three Rb1+ and three Ge4+ atoms. In the sixth As3- site, As3- is bonded in a 1-coordinate geometry to three Rb1+, one Ge4+, and two equivalent As3- atoms. Both As–As bond lengths are 2.51 Å. In the seventh As3- site, As3- is bonded in a 6-coordinate geometry to three Rb1+, one Ge4+, and two equivalent As3- atoms.

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Materials Data on Rb3TbF6 by Materials Project

Rb3TbF6 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to four equivalent F1- atoms. All Rb–F bond lengths are 2.80 Å. In the second Rb1+ site, Rb1+ is bonded in a linear geometry to two equivalent F1- atoms. Both Rb–F bond lengths are 2.59 Å. Tb3+ is bonded in an octahedral geometry to six F1- atoms. There are four shorter (2.19 Å) and two longer (2.23 Å) Tb–F bond lengths. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Rb1+ and one Tb3+ atom. In the second F1- site, F1- is bonded in a linear geometry to one Rb1+ and one Tb3+ atom.

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Materials Data on Rb3Ho(PO4)2 by Materials Project

Rb3Ho(PO4)2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are one shorter (2.77 Å) and six longer (2.97 Å) Rb–O bond lengths. In the second Rb1+ site, Rb1+ is bonded to twelve O2- atoms to form RbO12 cuboctahedra that share edges with six equivalent RbO12 cuboctahedra, edges with six equivalent PO4 tetrahedra, and faces with two equivalent HoO6 octahedra. There are six shorter (3.33 Å) and six longer (3.40 Å) Rb–O bond lengths. Ho3+ is bonded to six equivalent O2- atoms to form HoO6 octahedra that share corners with six equivalent PO4 tetrahedra and faces with two equivalent RbO12 cuboctahedra. All Ho–O bond lengths are 2.25 Å. P5+ is bonded to four O2- atoms to form PO4 tetrahedra that share corners with three equivalent HoO6 octahedra and edges with three equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 14°. There is one shorter (1.52 Å) and three longer (1.57 Å) P–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to four Rb1+ and one P5+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to three Rb1+, one Ho3+, and one P5+ atom.

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Materials Data on Rb2MoSe4 by Materials Project

Rb2MoSe4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 9-coordinate geometry to nine Se2- atoms. There are a spread of Rb–Se bond distances ranging from 3.45–3.84 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight Se2- atoms. There are a spread of Rb–Se bond distances ranging from 3.71–3.93 Å. Mo6+ is bonded in a tetrahedral geometry to four Se2- atoms. There are three shorter (2.33 Å) and one longer (2.35 Å) Mo–Se bond lengths. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in a 1-coordinate geometry to four Rb1+ and one Mo6+ atom. In the second Se2- site, Se2- is bonded in a 6-coordinate geometry to five Rb1+ and one Mo6+ atom. In the third Se2- site, Se2- is bonded in a 5-coordinate geometry to four Rb1+ and one Mo6+ atom.

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Materials Data on RbCOF3 by Materials Project

RbCOF3 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Rb1+ is bonded in a 12-coordinate geometry to three equivalent O2- and seven F1- atoms. There are a spread of Rb–O bond distances ranging from 2.92–3.01 Å. There are a spread of Rb–F bond distances ranging from 2.95–3.27 Å. C4+ is bonded in a tetrahedral geometry to one O2- and three F1- atoms. The C–O bond length is 1.23 Å. There are a spread of C–F bond distances ranging from 1.43–1.47 Å. O2- is bonded in a single-bond geometry to three equivalent Rb1+ and one C4+ atom. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to three equivalent Rb1+ and one C4+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to three equivalent Rb1+ and one C4+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Rb1+ and one C4+ atom.

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Materials Data on Rb2UF7 by Materials Project

Rb2UF7 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 1-coordinate geometry to eight F1- atoms. There are a spread of Rb–F bond distances ranging from 2.54–3.28 Å. In the second Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of Rb–F bond distances ranging from 2.61–3.24 Å. U5+ is bonded in an octahedral geometry to six F1- atoms. There are a spread of U–F bond distances ranging from 2.08–2.11 Å. There are seven inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted single-bond geometry to two Rb1+ and one U5+ atom. In the second F1- site, F1- is bonded in a 1-coordinate geometry to one Rb1+ and one U5+ atom. In the third F1- site, F1- is bonded in a distorted single-bond geometry to three Rb1+ and one U5+ atom. In the fourth F1- site, F1- is bonded in a distorted single-bond geometry to one Rb1+ and one U5+ atom. In the fifth F1- site, F1- is bonded in a distorted single-bond geometry to two equivalent Rb1+ and one U5+ atom. In the sixth F1- site, F1- is bonded in a distorted trigonal planar geometry to three Rb1+ atoms. In the seventh F1- site, F1- is bonded in a distorted single-bond geometry to two Rb1+ and one U5+ atom.

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Materials Data on Rb2Cu2Sb2S5 by Materials Project

Rb2Cu2Sb2S5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to seven S2- atoms. There are a spread of Rb–S bond distances ranging from 3.29–3.75 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight S2- atoms. There are a spread of Rb–S bond distances ranging from 3.37–3.64 Å. There are two inequivalent Cu1+ sites. In the first Cu1+ site, Cu1+ is bonded to four S2- atoms to form corner-sharing CuS4 tetrahedra. There are a spread of Cu–S bond distances ranging from 2.36–2.43 Å. In the second Cu1+ site, Cu1+ is bonded in a trigonal planar geometry to three S2- atoms. There are a spread of Cu–S bond distances ranging from 2.29–2.35 Å. There are two inequivalent Sb3+ sites. In the first Sb3+ site, Sb3+ is bonded in a trigonal non-coplanar geometry to three S2- atoms. There are a spread of Sb–S bond distances ranging from 2.45–2.52 Å. In the second Sb3+ site, Sb3+ is bonded in a distorted T-shaped geometry to three S2- atoms. There are a spread of Sb–S bond distances ranging from 2.40–2.55 Å. There are five inequivalent S2- sites. In the first S2- site, S2- is bonded in a 6-coordinate geometry to four equivalent Rb1+, one Cu1+, and one Sb3+ atom. In the second S2- site, S2- is bonded to two Rb1+, two equivalent Cu1+, and one Sb3+ atom to form distorted corner-sharing SRb2Cu2Sb trigonal bipyramids. In the third S2- site, S2- is bonded in a 5-coordinate geometry to three equivalent Rb1+ and two equivalent Sb3+ atoms. In the fourth S2- site, S2- is bonded in a 6-coordinate geometry to three equivalent Rb1+, two equivalent Cu1+, and one Sb3+ atom. In the fifth S2- site, S2- is bonded in a 6-coordinate geometry to three equivalent Rb1+, two Cu1+, and one Sb3+ atom.

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Materials Data on Rb3NiO2 by Materials Project

Rb3NiO2 crystallizes in the tetragonal P4_12_12 space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded to four equivalent O2- atoms to form a mixture of corner and edge-sharing RbO4 tetrahedra. There are a spread of Rb–O bond distances ranging from 2.91–2.98 Å. In the second Rb1+ site, Rb1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Rb–O bond lengths are 2.71 Å. Ni1+ is bonded in a linear geometry to two equivalent O2- atoms. Both Ni–O bond lengths are 1.80 Å. O2- is bonded in a 6-coordinate geometry to five Rb1+ and one Ni1+ atom.

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Materials Data on Rb2NiP2 by Materials Project

Rb2NiP2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six equivalent P2- atoms. There are four shorter (3.52 Å) and two longer (3.56 Å) Rb–P bond lengths. In the second Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six equivalent P2- atoms. There are two shorter (3.42 Å) and four longer (3.72 Å) Rb–P bond lengths. Ni2+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent P2- atoms. All Ni–P bond lengths are 2.25 Å. P2- is bonded in a 9-coordinate geometry to six Rb1+, two equivalent Ni2+, and one P2- atom. The P–P bond length is 2.18 Å.

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Materials Data on Rb3PrCl6 by Materials Project

(Rb)2RbPrCl6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of eight rubidium molecules and one RbPrCl6 framework. In the RbPrCl6 framework, Rb1+ is bonded to six equivalent Cl1- atoms to form RbCl6 octahedra that share corners with six equivalent PrCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Rb–Cl bond lengths are 3.12 Å. Pr3+ is bonded to six equivalent Cl1- atoms to form PrCl6 octahedra that share corners with six equivalent RbCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Pr–Cl bond lengths are 2.75 Å. Cl1- is bonded in a linear geometry to one Rb1+ and one Pr3+ atom.

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Materials Data on CsRbSO4 by Materials Project

CsRbSO4 crystallizes in the trigonal P3m1 space group. The structure is three-dimensional. there are two inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded to twelve O2- atoms to form distorted CsO12 cuboctahedra that share edges with six equivalent CsO12 cuboctahedra, edges with six SO4 tetrahedra, and faces with two equivalent RbO6 octahedra. There are a spread of Cs–O bond distances ranging from 3.28–3.67 Å. In the second Cs1+ site, Cs1+ is bonded in a 7-coordinate geometry to ten O2- atoms. There are a spread of Cs–O bond distances ranging from 2.97–3.60 Å. There are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 7-coordinate geometry to ten O2- atoms. There are a spread of Rb–O bond distances ranging from 3.00–3.55 Å. In the second Rb1+ site, Rb1+ is bonded to six O2- atoms to form RbO6 octahedra that share corners with six SO4 tetrahedra and faces with two equivalent CsO12 cuboctahedra. There are three shorter (2.80 Å) and three longer (2.81 Å) Rb–O bond lengths. There are two inequivalent S6+ sites. In the first S6+ site, S6+ is bonded to four O2- atoms to form SO4 tetrahedra that share corners with three equivalent RbO6 octahedra and edges with three equivalent CsO12 cuboctahedra. The corner-sharing octahedral tilt angles are 17°. There is one shorter (1.47 Å) and three longer (1.51 Å) S–O bond length. In the second S6+ site, S6+ is bonded to four O2- atoms to form SO4 tetrahedra that share corners with three equivalent RbO6 octahedra and edges with three equivalent CsO12 cuboctahedra. The corner-sharing octahedral tilt angles are 17°. There is one shorter (1.48 Å) and three longer (1.50 Å) S–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to three Cs1+, two Rb1+, and one S6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to four Cs1+ and one S6+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to two Cs1+, three Rb1+, and one S6+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent Cs1+, one Rb1+, and one S6+ atom.

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Materials Data on Rb2MnI4 by Materials Project

Rb2MnI4 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a 6-coordinate geometry to six I1- atoms. There are a spread of Rb–I bond distances ranging from 3.69–3.84 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight I1- atoms. There are a spread of Rb–I bond distances ranging from 3.77–4.36 Å. Mn2+ is bonded in a tetrahedral geometry to four I1- atoms. There are a spread of Mn–I bond distances ranging from 2.68–2.70 Å. There are three inequivalent I1- sites. In the first I1- site, I1- is bonded in a 3-coordinate geometry to two Rb1+ and one Mn2+ atom. In the second I1- site, I1- is bonded to four Rb1+ and one Mn2+ atom to form a mixture of distorted face, edge, and corner-sharing IRb4Mn square pyramids. In the third I1- site, I1- is bonded in a 3-coordinate geometry to four Rb1+ and one Mn2+ atom.

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Materials Data on Rb2Ba6Sb5HO by Materials Project

Rb2Ba6Sb5HO crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to six equivalent Sb+2.60- and two equivalent H1+ atoms. There are four shorter (3.91 Å) and two longer (4.00 Å) Rb–Sb bond lengths. Both Rb–H bond lengths are 3.32 Å. There are two inequivalent Ba2+ sites. In the first Ba2+ site, Ba2+ is bonded in a single-bond geometry to five Sb+2.60- and one O2- atom. There are a spread of Ba–Sb bond distances ranging from 3.59–3.86 Å. The Ba–O bond length is 2.56 Å. In the second Ba2+ site, Ba2+ is bonded to four equivalent Sb+2.60- and one H1+ atom to form distorted corner-sharing BaSb4H square pyramids. All Ba–Sb bond lengths are 3.58 Å. The Ba–H bond length is 2.66 Å. There are two inequivalent Sb+2.60- sites. In the first Sb+2.60- site, Sb+2.60- is bonded in a 9-coordinate geometry to three equivalent Rb1+, five Ba2+, and one Sb+2.60- atom. The Sb–Sb bond length is 2.94 Å. In the second Sb+2.60- site, Sb+2.60- is bonded in a 8-coordinate geometry to eight equivalent Ba2+ atoms. H1+ is bonded in a linear geometry to four equivalent Rb1+ and two equivalent Ba2+ atoms. O2- is bonded in a tetrahedral geometry to four equivalent Ba2+ atoms.

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Materials Data on Rb2Np2O5 by Materials Project

Rb2Np2O5 crystallizes in the tetragonal P4/mmm space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Rb–O bond lengths are 3.03 Å. In the second Rb1+ site, Rb1+ is bonded to twelve O2- atoms to form RbO12 cuboctahedra that share corners with four equivalent RbO12 cuboctahedra, faces with four equivalent RbO12 cuboctahedra, and faces with eight equivalent NpO5 square pyramids. There are four shorter (3.08 Å) and eight longer (3.21 Å) Rb–O bond lengths. Np4+ is bonded to five O2- atoms to form NpO5 square pyramids that share corners with five equivalent NpO5 square pyramids and faces with four equivalent RbO12 cuboctahedra. There are one shorter (2.15 Å) and four longer (2.19 Å) Np–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to four Rb1+ and two equivalent Np4+ atoms. In the second O2- site, O2- is bonded in a distorted linear geometry to four equivalent Rb1+ and two equivalent Np4+ atoms.

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Materials Data on Rb8SbO3 by Materials Project

Rb8SbO3 crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb1+ is bonded to one Sb2- and three equivalent O2- atoms to form a mixture of distorted edge and corner-sharing RbSbO3 tetrahedra. The Rb–Sb bond length is 3.46 Å. All Rb–O bond lengths are 3.16 Å. Sb2- is bonded in a body-centered cubic geometry to eight equivalent Rb1+ atoms. O2- is bonded in a body-centered cubic geometry to eight equivalent Rb1+ atoms.

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