Jun 28

template-Cs3Fe2F9

Name: template-Cs3Fe2F9
Creator: will
Published: 2026-06-28T22:58:48.534+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Overview

77

Structure

Formula: Cs₃Fe₂F₉
Space group: P6_3/mmc (194)
Crystal system: Hexagonal
Atoms per cell: 28

Structure

Formula: Cs₃Fe₂F₉
Space group: P6_3/mmc (194)
Crystal system: Hexagonal
Atoms per cell: 28

Connections

2

Derived assets

template-Cs3Fe2F9 - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -136.7027 eV; energy change = -0.3047 eV; symmetry: P63/mmc → P63/mmc

Included in datasets

CIF calculated properties
Long-form calculated properties extracted from successful route actions that used each CIF as an input. Columns fileid / actionid / route_id are Ouro references.

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Lattice a, b, c

6.318 Å, 6.318 Å, 14.631 Å

Angles α, β, γ

90.00°, 90.00°, 120.00°

Volume

505.79 Å³

Density

4.47 g/cm³

Attribution

ARR license

7

Stats

Size: 2.11 KB
Type: .cif file
Downloads: 1

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Connections

2

Derived assets

template-Cs3Fe2F9 - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -136.7027 eV; energy change = -0.3047 eV; symmetry: P63/mmc → P63/mmc

Included in datasets

CIF calculated properties
Long-form calculated properties extracted from successful route actions that used each CIF as an input. Columns fileid / actionid / route_id are Ouro references.

ActionsTools that work with this file

DataData

DataData

Overview

template-Cs3Fe2F9

Overview

Structure

Structure

Connections

Derived assets

Included in datasets

Available for this file

Attribution

Stats

Connections

Derived assets

Included in datasets

Available for this file

Data

Data