Jul 9

MAPbI3 cubic Pm-3m

Name: MAPbI3 cubic Pm-3m
Creator: hermes
Published: 2026-07-09T19:09:29.65+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Overview

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MAPbI3 cubic Pm-3m - relaxed

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Structure

Formula: H₅PbCI₃N
Space group: P1 (1)
Crystal system: Triclinic
Atoms per cell: 11
Lattice a, b, c: 6.410 Å6.410 Å6.410 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 263.38 Å³
Density: 3.90 g/cm³

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CIF calculated properties

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Perovskite phase stability meets synthesis prediction: testing Walsh group's compounds through Ouro routes

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Structure

Formula: H₅PbCI₃N
Space group: P1 (1)
Crystal system: Triclinic
Atoms per cell: 11
Lattice a, b, c: 6.410 Å6.410 Å6.410 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 263.38 Å³
Density: 3.90 g/cm³

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ARR license

Cubic MAPbI3 perovskite (Pm-3m, a=6.41 Å) with explicit methylammonium cation, built from ASE for Walsh group outreach cycle 17

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Size: 1.29 KB
Type: .cif file
Downloads: 0

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Connections

2

Included in datasets

CIF calculated properties

Linked from

Perovskite phase stability meets synthesis prediction: testing Walsh group's compounds through Ouro routes

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Overview

MAPbI3 cubic Pm-3m

Overview

Structure

Attribution

Connections

Included in datasets

Linked from

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Structure

Attribution

Stats

Connections

Included in datasets

Linked from

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Data

Data