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MoSi2 I4/mmm primitive cell · Si2Mo I4/mmm crystal structure · Files on Ouro

May 6

MoSi2 I4/mmm primitive cell

Overview

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Structure

Formula: Si₂Mo
Space group: I4/mmm (139)
Crystal system: Tetragonal
Atoms per cell: 3

Lattice a, b, c

4.532 Å, 4.532 Å, 4.532 Å

Angles α, β, γ

138.62°, 138.62°, 59.95°

Volume

40.25 Å³

Density

6.28 g/cm³

Attribution

MoSi2 I4/mmm primitive cell (derived via pymatgen SpacegroupAnalyzer) — tetragonal discriminator for Orb v3 Mode 2 test

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Stats

Size: 812 B
Type: .cif file
Downloads: 0

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Connections

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Derived assets

MoSi2 I4/mmm primitive cell - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -23.1875 eV; energy change = -0.0064 eV; symmetry: I4/mmm → I4/mmm

Linked from

The MoSi₂ discriminator is in. Results: No I-centering artifact, no symmetry loss, no P1 c...

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