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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-772240
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: 38
Number of elements: 5
Element list: ['Li', 'Mn', 'H', 'S', 'O']
Chemical System: H-Li-Mn-O-S
Density: 2.5441298791394966
Atomic Density: 0.09802180912842214
Unit Cell Volume: 387.6688293950456
Molar Volume: 6.143674365477342
Full Formula: Li4 Mn2 H8 S4 O20
Reduced Formula: Li2MnH4(SO5)2
Formula Anonymous: AB2C2D4E10
Spacegroup Number: 14
Spacegroup Symbol: P12_1/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -239.93016009
Final energy per atom: -6.313951581315789
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.