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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-642975
Created at: Sept. 4, 2022, 2:43 p.m.
Last updated at: Nov. 28, 2021, 1:36 a.m.
Input Source: Materials Project

Structure:

Number of sites: 104
Number of elements: 5
Element list: ['Cr', 'Bi', 'Mo', 'Pb', 'O']
Chemical System: Bi-Cr-Mo-O-Pb
Density: 7.121725804428734
Atomic Density: 0.06036153224563652
Unit Cell Volume: 1722.9516238385095
Molar Volume: 9.976785770601994
Full Formula: Cr2 Bi24 Mo8 Pb2 O68
Reduced Formula: CrBi12Mo4PbO34
Formula Anonymous: ABC4D12E34
Spacegroup Number: 13
Spacegroup Symbol: P12/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -730.9967963800001
Final energy per atom: -7.028815349807693
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.