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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-770500
Created at: Sept. 4, 2022, 2:48 p.m.
Last updated at: Nov. 28, 2021, 1:38 a.m.
Input Source: Materials Project

Structure:

Number of sites: 58
Number of elements: 5
Element list: ['Na', 'Mn', 'B', 'S', 'O']
Chemical System: B-Mn-Na-O-S
Density: 2.8596823849170994
Atomic Density: 0.0862387707274373
Unit Cell Volume: 672.5513305762719
Molar Volume: 6.983101346647588
Full Formula: Na12 Mn4 B8 S2 O32
Reduced Formula: Na6Mn2B4SO16
Formula Anonymous: AB2C4D6E16
Spacegroup Number: 203
Spacegroup Symbol: Fd-31
Crystal System: cubic
Pointgroup: m-3

Thermodynamics:

Final energy: -408.69374658
Final energy per atom: -7.0464439065517235
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.