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Apr 4

Mn2FeGe (Pmm2)

Overview

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Structure

Formula: Mn₂FeGe
Space group: Pmm2 (25)
Crystal system: Orthorhombic
Atoms per cell: 4

Lattice a, b, c

2.630 Å, 3.641 Å, 5.083 Å

Angles α, β, γ

90.00°, 90.00°, 90.00°

Volume

48.68 Å³

Density

8.13 g/cm³

Attribution

Mn2FeGe (space group: Pmm2 #25, crystal system: orthorhombic, point group: mm2)

Mn2FeGe (Pmm2) · Pmm2 crystal structure · Files on Ouro

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Stats

Size: 756 B
Type: .cif file
Downloads: 0

Created by route

Generate a crystal structure with CrystaLLM

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Connections

4

Derived assets

Mn2FeGe (Pmm2) - relaxed 1
.cif
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -31.4592 eV; energy change = -0.0116 eV; symmetry: Pmm2 → Pmm2
Mn2FeGe (Pmm2) - geometry optimization report
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -31.4592 eV; ΔE = -0.0116 eV; symmetry: Pmm2 → Pmm2

Referenced by

Mn2FeGe (Pmm2) - geometry optimization report
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -31.4592 eV; ΔE = -0.0116 eV; symmetry: Pmm2 → Pmm2

Linked from

Mn₂YZ Heusler candidates generated — CrystaLLM outputs orthorhombic Pmm2
CrystaLLM generated orthorhombic Pmm2 structures for three Mn₂YZ Heusler targets — NequIP relaxation next step

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