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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-756274
Created at: Sept. 4, 2022, 2:45 p.m.
Last updated at: Nov. 28, 2021, 1:37 a.m.
Input Source: Materials Project

Structure:

Number of sites: 26
Number of elements: 5
Element list: ['Na', 'Fe', 'B', 'P', 'O']
Chemical System: B-Fe-Na-O-P
Density: 2.9464901324512733
Atomic Density: 0.08279919814913993
Unit Cell Volume: 314.0127027941523
Molar Volume: 7.273187294824733
Full Formula: Na6 Fe2 B2 P2 O14
Reduced Formula: Na3FeBPO7
Formula Anonymous: ABCD3E7
Spacegroup Number: 11
Spacegroup Symbol: P12_1/m1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -181.27428036
Final energy per atom: -6.972087706153847
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.