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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-23783
Created at: Sept. 4, 2022, 2:41 p.m.
Last updated at: Nov. 28, 2021, 1:35 a.m.
Input Source: Materials Project

Structure:

Number of sites: 58
Number of elements: 6
Element list: ['Ga', 'Ni', 'P', 'H', 'N', 'O']
Chemical System: Ga-H-N-Ni-O-P
Density: 3.035337644462794
Atomic Density: 0.09869213823383563
Unit Cell Volume: 587.686122095947
Molar Volume: 6.101945775793688
Full Formula: Ga4 Ni2 P6 H16 N2 O28
Reduced Formula: Ga2NiP3H8NO14
Formula Anonymous: ABC2D3E8F14
Spacegroup Number: 15
Spacegroup Symbol: C12/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -376.18846071
Final energy per atom: -6.486007943275863
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.