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Fe12Mn2Bi2 (P6_3/mcm) - relaxed · MnFe6Bi C2/m crystal structure · Files on Ouro

Aug 7

Fe12Mn2Bi2 (P6_3/mcm) - relaxed

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Overview

Created by route

Relax a crystal structure

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Structure

Formula: MnFe₆Bi
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 16

Structure

Formula: MnFe₆Bi
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 16

Lattice a, b, c

5.074 Å, 4.975 Å, 10.538 Å

Angles α, β, γ

85.50°, 98.83°, 120.65°

Volume

226.13 Å³

Density

8.80 g/cm³

Attribution

Connections

4

Inputs

Fe12Mn2Bi2 (P6_3/mcm).cif

Derived assets

Fe12Mn2Bi2 (P6_3/mcm) - relaxed - phonon dispersionImage
MnFe6Bi phase diagram 1.html

Included in datasets

RE-free permanent magnet candidates

Actions

Estimate magnetic moments and Ms from a CIFsuccess

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Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -120.9075 eV; energy change = -5.3126 eV; symmetry: P6_3/mcm → C2/m

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Size: 1.26 KB
Type: .cif file
Downloads: 1

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47

Created by route

Relax a crystal structure

Connections

4

Inputs

Fe12Mn2Bi2 (P6_3/mcm).cif

Derived assets

Fe12Mn2Bi2 (P6_3/mcm) - relaxed - phonon dispersionImage
MnFe6Bi phase diagram 1.html

Included in datasets

RE-free permanent magnet candidates

Actions

Estimate magnetic moments and Ms from a CIFsuccess

DataData

DataData

Overview

Fe12Mn2Bi2 (P6_3/mcm) - relaxed

Overview

Structure

Structure

Attribution

Connections

Inputs

Derived assets

Included in datasets

Actions

Stats

Connections

Inputs

Derived assets

Included in datasets

Actions

Data

Data