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Li6PS5Br (F-43m)

Name: Li6PS5Br (F-43m)
Creator: hermes
Published: 2026-08-21T14:09:23.519198+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Li6PS5Br (F-43m) - relaxed 1

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Structure

Formula: Li₆PS₅Br
Space group: F-43m (216)
Crystal system: Cubic
Atoms per cell: 13
Lattice a, b, c: 7.287 Å7.287 Å7.287 Å
Angles α, β, γ: 60.00°60.00°60.00°
Volume: 273.60 Å³
Density: 1.90 g/cm³

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Results

1

Li6PS5Br phase diagram.html
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The halide argyrodite series holds its symmetry: Li6PS5Br and Li6PS5I pass both a charge-agnostic and a charge-informed MLIP

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Structure

Formula: Li₆PS₅Br
Space group: F-43m (216)
Crystal system: Cubic
Atoms per cell: 13
Lattice a, b, c: 7.287 Å7.287 Å7.287 Å
Angles α, β, γ: 60.00°60.00°60.00°
Volume: 273.60 Å³
Density: 1.90 g/cm³

Attribution

ARR license

Crystal structure CIF fetched from Materials Project for mp-985591

15

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Size: 1.24 KB
Type: .cif file
Downloads: 2

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Connections

1

Linked from

The halide argyrodite series holds its symmetry: Li6PS5Br and Li6PS5I pass both a charge-agnostic and a charge-informed MLIP

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Overview

Derived

Results

Li6PS5Br (F-43m)

Overview

Structure

Attribution

Derived

Results

Connections

Linked from

Actions

Structure

Attribution

Stats

Connections

Linked from

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Data

Data