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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197400

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-1197400
  • 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: 100
  • Number of elements: 3
  • Element list: ['Mn', 'Pb', 'O']
  • Chemical System: Mn-O-Pb
  • Density: 6.5746656379496775
  • Atomic Density: 0.07943130746568472
  • Unit Cell Volume: 1258.9494393404163
  • Molar Volume: 7.581570733431069
  • Full Formula: Mn28 Pb12 O60
  • Reduced Formula: Mn7(PbO5)3
  • Formula Anonymous: A3B7C15
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -781.44884029
  • Final energy per atom: -7.8144884029
  • 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.