cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.17188/1320672
title: Materials Data on Ca3Ni2O7 by Materials Project

description: Ca3Ni2O7 is Orthorhombic Perovskite-like structured and crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Ca2+ sites. In the first Ca2+ site, Ca2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Ca–O bond distances ranging from 2.34–2.63 Å. In the second Ca2+ site, Ca2+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ca–O bond distances ranging from 2.28–2.48 Å. Ni4+ is bonded to six O2- atoms to form corner-sharing NiO6 octahedra. The corner-sharing octahedra tilt angles range from 24–25°. There are a spread of Ni–O bond distances ranging from 1.92–1.95 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent Ca2+ and one Ni4+ atom. In the second O2- site, O2- is bonded in a 5-coordinate geometry to three Ca2+ and two equivalent Ni4+ atoms. In the third O2- site, O2- is bonded in a 5-coordinate geometry to three Ca2+ and two equivalent Ni4+ atoms. In the fourth O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Ca2+ and two equivalent Ni4+ atoms.
DOI: 10.17188/1320673
title: Materials Data on MgVF4 by Materials Project

description: MgVF4 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Mg2+ is bonded to six F1- atoms to form distorted MgF6 octahedra that share corners with four equivalent VF6 octahedra and edges with two equivalent MgF6 octahedra. The corner-sharing octahedra tilt angles range from 52–63°. There are a spread of Mg–F bond distances ranging from 1.91–2.18 Å. There are two inequivalent V2+ sites. In the first V2+ site, V2+ is bonded to six F1- atoms to form VF6 octahedra that share corners with eight equivalent MgF6 octahedra. The corner-sharing octahedra tilt angles range from 52–63°. There are a spread of V–F bond distances ranging from 2.05–2.28 Å. In the second V2+ site, V2+ is bonded in a 6-coordinate geometry to six F1- atoms. There are a spread of V–F bond distances ranging from 2.05–2.29 Å. There are four inequivalent F1- sites. In the first F1- site, F1- is bonded to two equivalent Mg2+ and two V2+ atoms to form a mixture of distorted corner and edge-sharing FMg2V2 tetrahedra. In the second F1- site, F1- is bonded in a bent 120 degrees geometry to one Mg2+ and one V2+ atom. In the third F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Mg2+ and one V2+ atom. In the fourth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Mg2+ and two V2+ atoms.
DOI: 10.17188/1320674
title: Materials Data on Ca3W2O7 by Materials Project

description: Ca3W2O7 crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Ca2+ sites. In the first Ca2+ site, Ca2+ is bonded in a 4-coordinate geometry to eight O2- atoms. There are a spread of Ca–O bond distances ranging from 2.36–2.76 Å. In the second Ca2+ site, Ca2+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ca–O bond distances ranging from 2.29–2.70 Å. W4+ is bonded to six O2- atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedra tilt angles range from 32–35°. There are a spread of W–O bond distances ranging from 2.05–2.16 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded to three equivalent Ca2+ and one W4+ atom to form distorted corner-sharing OCa3W tetrahedra. In the second O2- site, O2- is bonded in a 5-coordinate geometry to three Ca2+ and two equivalent W4+ atoms. In the third O2- site, O2- is bonded in a 5-coordinate geometry to three Ca2+ and two equivalent W4+ atoms. In the fourth O2- site, O2- is bonded to two equivalent Ca2+ and two equivalent W4+ atoms to form distorted corner-sharing OCa2W2 tetrahedra.
DOI: 10.17188/1320676
title: Materials Data on MgCoF5 by Materials Project

description: MgCoF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Mg2+ is bonded to seven F1- atoms to form distorted MgF7 pentagonal bipyramids that share corners with four equivalent CoF6 octahedra, edges with two equivalent CoF6 octahedra, and edges with two equivalent MgF7 pentagonal bipyramids. The corner-sharing octahedra tilt angles range from 10–42°. There are a spread of Mg–F bond distances ranging from 1.95–2.45 Å. Co3+ is bonded to six F1- atoms to form CoF6 octahedra that share corners with two equivalent CoF6 octahedra, corners with four equivalent MgF7 pentagonal bipyramids, and edges with two equivalent MgF7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 45°. There are a spread of Co–F bond distances ranging from 1.85–2.00 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 2-coordinate geometry to two equivalent Mg2+ and one Co3+ atom. In the second F1- site, F1- is bonded in a 2-coordinate geometry to two equivalent Mg2+ and one Co3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Mg2+ and one Co3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Mg2+ and one Co3+ atom. In the fifth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Mg2+ and two equivalent Co3+ atoms.
DOI: 10.17188/1320677
title: Materials Data on CaCrF5 by Materials Project

description: CaCrF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded to seven F1- atoms to form distorted CaF7 pentagonal bipyramids that share corners with four equivalent CrF6 octahedra, edges with two equivalent CrF6 octahedra, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedra tilt angles range from 13–45°. There are a spread of Ca–F bond distances ranging from 2.23–2.54 Å. Cr3+ is bonded to six F1- atoms to form CrF6 octahedra that share corners with two equivalent CrF6 octahedra, corners with four equivalent CaF7 pentagonal bipyramids, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 30°. There are a spread of Cr–F bond distances ranging from 1.90–1.98 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ca2+ and one Cr3+ atom. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Ca2+ and one Cr3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Ca2+ and one Cr3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Ca2+ and one Cr3+ atom. In the fifth F1- site, F1- is bonded in a 2-coordinate geometry to one Ca2+ and two equivalent Cr3+ atoms.
DOI: 10.17188/1320678
title: Materials Data on CaCoF5 by Materials Project

description: CaCoF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded to seven F1- atoms to form distorted CaF7 pentagonal bipyramids that share corners with four equivalent CoF6 octahedra, edges with two equivalent CoF6 octahedra, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedra tilt angles range from 13–45°. There are a spread of Ca–F bond distances ranging from 2.23–2.46 Å. Co3+ is bonded to six F1- atoms to form CoF6 octahedra that share corners with two equivalent CoF6 octahedra, corners with four equivalent CaF7 pentagonal bipyramids, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 32°. There are a spread of Co–F bond distances ranging from 1.85–2.00 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ca2+ and one Co3+ atom. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Ca2+ and one Co3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Ca2+ and one Co3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Ca2+ and one Co3+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to one Ca2+ and two equivalent Co3+ atoms.
DOI: 10.17188/1320679
title: Materials Data on CaMnF5 by Materials Project

description: CaMnF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded to seven F1- atoms to form distorted CaF7 pentagonal bipyramids that share corners with four equivalent MnF6 octahedra, edges with two equivalent MnF6 octahedra, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedra tilt angles range from 15–45°. There are a spread of Ca–F bond distances ranging from 2.24–2.52 Å. Mn3+ is bonded to six F1- atoms to form MnF6 octahedra that share corners with two equivalent MnF6 octahedra, corners with four equivalent CaF7 pentagonal bipyramids, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 36°. There are a spread of Mn–F bond distances ranging from 1.86–2.12 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Ca2+ and one Mn3+ atom. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Ca2+ and one Mn3+ atom. In the third F1- site, F1- is bonded in a distorted bent 150 degrees geometry to one Ca2+ and one Mn3+ atom. In the fourth F1- site, F1- is bonded in a distorted linear geometry to one Ca2+ and one Mn3+ atom. In the fifth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Ca2+ and two equivalent Mn3+ atoms.
DOI: 10.17188/1320680
title: Materials Data on ZnCrF5 by Materials Project

description: CrZnF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Cr3+ is bonded to six F1- atoms to form corner-sharing CrF6 octahedra. The corner-sharing octahedral tilt angles are 33°. There are a spread of Cr–F bond distances ranging from 1.93–1.96 Å. Zn2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Zn–F bond distances ranging from 1.94–2.55 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to one Cr3+ and two equivalent Zn2+ atoms. In the second F1- site, F1- is bonded in a 3-coordinate geometry to one Cr3+ and two equivalent Zn2+ atoms. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Cr3+ and one Zn2+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Cr3+ and one Zn2+ atom. In the fifth F1- site, F1- is bonded in a distorted bent 150 degrees geometry to two equivalent Cr3+ and one Zn2+ atom.
DOI: 10.17188/1320681
title: Materials Data on CaMoF5 by Materials Project

description: CaMoF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded to seven F1- atoms to form distorted CaF7 pentagonal bipyramids that share corners with four equivalent MoF6 octahedra, edges with two equivalent MoF6 octahedra, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedra tilt angles range from 12–47°. There are a spread of Ca–F bond distances ranging from 2.22–2.55 Å. Mo3+ is bonded to six F1- atoms to form MoF6 octahedra that share corners with two equivalent MoF6 octahedra, corners with four equivalent CaF7 pentagonal bipyramids, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 39°. There are a spread of Mo–F bond distances ranging from 2.06–2.13 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ca2+ and one Mo3+ atom. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Ca2+ and one Mo3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Ca2+ and one Mo3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Ca2+ and one Mo3+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to one Ca2+ and two equivalent Mo3+ atoms.
DOI: 10.17188/1320682
title: Materials Data on MgVF5 by Materials Project

description: MgVF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Mg2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Mg–F bond distances ranging from 1.93–2.57 Å. V3+ is bonded to six F1- atoms to form corner-sharing VF6 octahedra. The corner-sharing octahedral tilt angles are 43°. There are a spread of V–F bond distances ranging from 1.92–2.04 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 2-coordinate geometry to two equivalent Mg2+ and one V3+ atom. In the second F1- site, F1- is bonded in a 2-coordinate geometry to two equivalent Mg2+ and one V3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Mg2+ and one V3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Mg2+ and one V3+ atom. In the fifth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Mg2+ and two equivalent V3+ atoms.
DOI: 10.17188/1320683
title: Materials Data on MgMnF5 by Materials Project

description: MgMnF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Mg2+ is bonded to six F1- atoms to form distorted MgF6 octahedra that share corners with five equivalent MnF6 octahedra, an edgeedge with one MgF6 octahedra, and an edgeedge with one MnF6 octahedra. The corner-sharing octahedra tilt angles range from 11–55°. There are a spread of Mg–F bond distances ranging from 1.98–2.24 Å. Mn3+ is bonded to six F1- atoms to form MnF6 octahedra that share corners with two equivalent MnF6 octahedra, corners with five equivalent MgF6 octahedra, and an edgeedge with one MgF6 octahedra. The corner-sharing octahedra tilt angles range from 11–55°. There are a spread of Mn–F bond distances ranging from 1.84–2.18 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a bent 150 degrees geometry to one Mg2+ and one Mn3+ atom. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Mg2+ and one Mn3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Mg2+ and one Mn3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Mg2+ and one Mn3+ atom. In the fifth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Mg2+ and two equivalent Mn3+ atoms.
DOI: 10.17188/1320684
title: Materials Data on MgFeF5 by Materials Project

description: MgFeF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Mg2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Mg–F bond distances ranging from 1.94–2.60 Å. Fe3+ is bonded to six F1- atoms to form corner-sharing FeF6 octahedra. The corner-sharing octahedral tilt angles are 44°. There are a spread of Fe–F bond distances ranging from 1.90–2.01 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 2-coordinate geometry to two equivalent Mg2+ and one Fe3+ atom. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Mg2+ and one Fe3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Mg2+ and one Fe3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Mg2+ and one Fe3+ atom. In the fifth F1- site, F1- is bonded in a distorted trigonal planar geometry to one Mg2+ and two equivalent Fe3+ atoms.
DOI: 10.17188/1320685
title: Materials Data on CaWF5 by Materials Project

description: CaWF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded to seven F1- atoms to form distorted CaF7 pentagonal bipyramids that share corners with four equivalent WF6 octahedra, edges with two equivalent WF6 octahedra, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedra tilt angles range from 11–47°. There are a spread of Ca–F bond distances ranging from 2.21–2.55 Å. W3+ is bonded to six F1- atoms to form WF6 octahedra that share corners with two equivalent WF6 octahedra, corners with four equivalent CaF7 pentagonal bipyramids, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 41°. There are a spread of W–F bond distances ranging from 2.08–2.14 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ca2+ and one W3+ atom. In the second F1- site, F1- is bonded in a distorted trigonal planar geometry to two equivalent Ca2+ and one W3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Ca2+ and one W3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Ca2+ and one W3+ atom. In the fifth F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to one Ca2+ and two equivalent W3+ atoms.
DOI: 10.17188/1320686
title: Materials Data on CaVF5 by Materials Project

description: CaVF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded to seven F1- atoms to form distorted CaF7 pentagonal bipyramids that share corners with four equivalent VF6 octahedra, edges with two equivalent VF6 octahedra, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedra tilt angles range from 13–45°. There are a spread of Ca–F bond distances ranging from 2.23–2.49 Å. V3+ is bonded to six F1- atoms to form VF6 octahedra that share corners with two equivalent VF6 octahedra, corners with four equivalent CaF7 pentagonal bipyramids, and edges with two equivalent CaF7 pentagonal bipyramids. The corner-sharing octahedral tilt angles are 32°. There are a spread of V–F bond distances ranging from 1.92–2.04 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ca2+ and one V3+ atom. In the second F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Ca2+ and one V3+ atom. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Ca2+ and one V3+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Ca2+ and one V3+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to one Ca2+ and two equivalent V3+ atoms.
DOI: 10.5281/zenodo.4481784
title: TMY hourly generation profiles for Insolight hybrid Si/III-V planar micro-tracking modules in Madrid

description: Hourly energy density (1 m<sup>2</sup>) generation profiles for Insolight hybrid Si/III-V planar micro-tracking modules installed in Madrid (40.5°N, -3.75°E), synthetically generated using CPVLIB library (based on PVLIB Python) and ERA5 typical meteorological year. Performance model parameters were empirically fitted using several outdoor monitoring campaigns and indoor characterization at the collimated-light solar simulator available at IES-UPM. <strong>Location</strong>: 40.5°N, -3.75°E <strong>Format</strong>: CSV (separator: semicolon); headers in first row. <strong>Parameters </strong>(ordered from first column): Time: YYYY-MM-DD HH:MM:SS+TimeZoneOffset Latitude: latitude of the installation in °N Longitude: longitude of the installation in °E Wind speed [m/s]: average wind speed Tair [°C]: average ambient temperature precipitable_water [mm]: average precipitable water in the atmosphere GHI [Wh/m2]: global horizontal irradiation DHI [Wh/m2]: diffuse horizontal irradiation DNI [Wh/m2]: direct (beam) normal irradiation CPV submodule [kWh/m2]: energy generated per m<sup>2</sup> by the III-V CPV submodule Flat-plate submodule [kWh/m2]: energy generated per m<sup>2</sup> by the Si flat-plate submodule Hybrid [kWh/m2]: energy generated per m<sup>2</sup> by the whole Insolight hybrid module
DOI: 10.17188/1320687
title: Materials Data on ZnCoF5 by Materials Project

description: CoZnF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Co3+ is bonded to six F1- atoms to form corner-sharing CoF6 octahedra. The corner-sharing octahedral tilt angles are 40°. There are a spread of Co–F bond distances ranging from 1.87–1.98 Å. Zn2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Zn–F bond distances ranging from 1.95–2.46 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 3-coordinate geometry to one Co3+ and two equivalent Zn2+ atoms. In the second F1- site, F1- is bonded in a 2-coordinate geometry to one Co3+ and two equivalent Zn2+ atoms. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one Co3+ and one Zn2+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one Co3+ and one Zn2+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent Co3+ and one Zn2+ atom.
DOI: 10.5281/zenodo.4481783
title: TMY hourly generation profiles for Insolight hybrid Si/III-V planar micro-tracking modules in Madrid

description: Hourly energy density (1 m<sup>2</sup>) generation profiles for Insolight hybrid Si/III-V planar micro-tracking modules installed in Madrid (40.5°N, -3.75°E), synthetically generated using CPVLIB library (based on PVLIB Python) and ERA5 typical meteorological year. Performance model parameters were empirically fitted using several outdoor monitoring campaigns and indoor characterization at the collimated-light solar simulator available at IES-UPM. <strong>Location</strong>: 40.5°N, -3.75°E <strong>Format</strong>: CSV (separator: semicolon); headers in first row. <strong>Parameters </strong>(ordered from first column): Time: YYYY-MM-DD HH:MM:SS+TimeZoneOffset Latitude: latitude of the installation in °N Longitude: longitude of the installation in °E Wind speed [m/s]: average wind speed Tair [°C]: average ambient temperature precipitable_water [mm]: average precipitable water in the atmosphere GHI [Wh/m2]: global horizontal irradiation DHI [Wh/m2]: diffuse horizontal irradiation DNI [Wh/m2]: direct (beam) normal irradiation CPV submodule [kWh/m2]: energy generated per m<sup>2</sup> by the III-V CPV submodule Flat-plate submodule [kWh/m2]: energy generated per m<sup>2</sup> by the Si flat-plate submodule Hybrid [kWh/m2]: energy generated per m<sup>2</sup> by the whole Insolight hybrid module
DOI: 10.17188/1320688
title: Materials Data on VZnF5 by Materials Project

description: VZnF5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. V3+ is bonded to six F1- atoms to form corner-sharing VF6 octahedra. The corner-sharing octahedral tilt angles are 40°. There are a spread of V–F bond distances ranging from 1.94–2.03 Å. Zn2+ is bonded in a 7-coordinate geometry to seven F1- atoms. There are a spread of Zn–F bond distances ranging from 1.95–2.62 Å. There are five inequivalent F1- sites. In the first F1- site, F1- is bonded in a 2-coordinate geometry to one V3+ and two equivalent Zn2+ atoms. In the second F1- site, F1- is bonded in a 2-coordinate geometry to one V3+ and two equivalent Zn2+ atoms. In the third F1- site, F1- is bonded in a bent 150 degrees geometry to one V3+ and one Zn2+ atom. In the fourth F1- site, F1- is bonded in a linear geometry to one V3+ and one Zn2+ atom. In the fifth F1- site, F1- is bonded in a 3-coordinate geometry to two equivalent V3+ and one Zn2+ atom.