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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-707485
Created at: Sept. 4, 2022, 2:39 p.m.
Last updated at: Nov. 28, 2021, 1:34 a.m.
Input Source: Materials Project

Structure:

Number of sites: 58
Number of elements: 5
Element list: ['K', 'Cu', 'As', 'H', 'O']
Chemical System: As-Cu-H-K-O
Density: 3.5345131617982326
Atomic Density: 0.0682279700396041
Unit Cell Volume: 850.0912450763653
Molar Volume: 8.826498511540567
Full Formula: K8 Cu6 As8 H4 O32
Reduced Formula: K4Cu3As4(HO8)2
Formula Anonymous: A2B3C4D4E16
Spacegroup Number: 14
Spacegroup Symbol: P12_1/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -339.52185519
Final energy per atom: -5.853825089482759
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.