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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-1034447
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: 32
Number of elements: 4
Element list: ['Mg', 'V', 'C', 'O']
Chemical System: C-Mg-O-V
Density: 3.5312823187398816
Atomic Density: 0.1032304501174876
Unit Cell Volume: 309.9860551182377
Molar Volume: 5.833686429872331
Full Formula: Mg14 V1 C1 O16
Reduced Formula: Mg14VCO16
Formula Anonymous: ABC14D16
Spacegroup Number: 123
Spacegroup Symbol: P4/mmm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -205.22425156
Final energy per atom: -6.41325786125
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.