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Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

Database Entry ID: mp-705194
Created at: Sept. 4, 2022, 2:40 p.m.
Last updated at: Nov. 28, 2021, 1:34 a.m.
Input Source: Materials Project

Structure:

Number of sites: 192
Number of elements: 5
Element list: ['Mn', 'Sn', 'C', 'Br', 'O']
Chemical System: Br-C-Mn-O-Sn
Density: 2.2327481895685652
Atomic Density: 0.05482620764998812
Unit Cell Volume: 3501.9748443250496
Molar Volume: 10.98405492213778
Full Formula: Mn16 Sn8 C80 Br8 O80
Reduced Formula: Mn2SnC10BrO10
Formula Anonymous: ABC2D10E10
Spacegroup Number: 14
Spacegroup Symbol: P12_1/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -1477.3976225600002
Final energy per atom: -7.694779284166668
Energy above hull: None
Is thermodynamically stable?: None
Decomposes to: None
Formation energy None
Formation energy per atom: None

Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.