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Version of · via Relax a crystal structure

Mn2Sb_P4nmm_Cu2Sb-type_ICSD.cif

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inMay 5

Mn2Sb_P4nmm_Cu2Sb-type_ICSD.cif - relaxed

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Mn2Sb_P4nmm_Cu2Sb-type_ICSD.cif - relaxed · Mn3Sb2 P1 crystal structure · Files on Ouro

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Version of · via Relax a crystal structure

Mn2Sb_P4nmm_Cu2Sb-type_ICSD.cif

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Structure

Formula: Mn₃Sb₂
Space group: P1 (1)
Crystal system: Triclinic
Atoms per cell: 15
Lattice a, b, c: 6.333 Å4.541 Å9.360 Å
Angles α, β, γ: 97.83°83.98°88.24°
Volume: 264.91 Å³
Density: 7.68 g/cm³

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Structure

Formula: Mn₃Sb₂
Space group: P1 (1)
Crystal system: Triclinic
Atoms per cell: 15
Lattice a, b, c: 6.333 Å4.541 Å9.360 Å
Angles α, β, γ: 97.83°83.98°88.24°
Volume: 264.91 Å³
Density: 7.68 g/cm³

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Cell + Ionic relaxation with CHGNet; 0.03 eV/Å threshold; final energy = -107.0135 eV; energy change = -112.2764 eV; symmetry: Pm → P1

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Type: .cif file
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Mn2Sb_P4nmm_Cu2Sb-type_ICSD.cif - relaxed

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