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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-759228
Created at: Sept. 4, 2022, 2:44 p.m.
Last updated at: Nov. 28, 2021, 1:37 a.m.
Input Source: Materials Project

Structure:

Number of sites: 86
Number of elements: 5
Element list: ['Li', 'Fe', 'P', 'H', 'O']
Chemical System: Fe-H-Li-O-P
Density: 2.1371367844189617
Atomic Density: 0.10446992855717768
Unit Cell Volume: 823.2033963049103
Molar Volume: 5.76447293797469
Full Formula: Li4 Fe2 P8 H32 O40
Reduced Formula: Li2FeP4(H4O5)4
Formula Anonymous: AB2C4D16E20
Spacegroup Number: 14
Spacegroup Symbol: P12_1/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -534.54236837
Final energy per atom: -6.215608934534884
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.