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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-778497
Created at: Sept. 4, 2022, 2:45 p.m.
Last updated at: Nov. 28, 2021, 1:36 a.m.
Input Source: Materials Project

Structure:

Number of sites: 58
Number of elements: 5
Element list: ['Na', 'Bi', 'P', 'C', 'O']
Chemical System: Bi-C-Na-O-P
Density: 3.7844838027370677
Atomic Density: 0.07418626104194952
Unit Cell Volume: 781.8159209722565
Molar Volume: 8.11759573190339
Full Formula: Na12 Bi4 P2 C8 O32
Reduced Formula: Na6Bi2P(CO4)4
Formula Anonymous: AB2C4D6E16
Spacegroup Number: 203
Spacegroup Symbol: Fd-31
Crystal System: cubic
Pointgroup: m-3

Thermodynamics:

Final energy: -391.03361976
Final energy per atom: -6.741958961379311
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.