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May 6

MoSi2 I4/mmm conventional cell

Overview

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Structure

Formula: Si₂Mo
Space group: I4/mmm (139)
Crystal system: Tetragonal
Atoms per cell: 6

Lattice a, b, c

3.202 Å, 3.202 Å, 7.851 Å

Angles α, β, γ

90.00°, 90.00°, 90.00°

Volume

80.50 Å³

Density

6.28 g/cm³

Attribution

MoSi2 I4/mmm conventional cell (ICSD: a=3.202, c=7.851, Mo 2a, Si 4e z=0.3353) — tetragonal discriminator for Orb v3 Mode 2 test

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

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Stats

Size: 966 B
Type: .cif file
Downloads: 0

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Derived assets

MoSi2 I4/mmm conventional cell - relaxed
.cif
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -46.3742 eV; energy change = -0.0127 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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