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  1. Third-Parties
  2. MatprojStructure
  3. mp-1199988

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-1199988
  • 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: 32
  • Number of elements: 4
  • Element list: ['Al', 'Pb', 'S', 'O']
  • Chemical System: Al-O-Pb-S
  • Density: 6.365615809458283
  • Atomic Density: 0.07159999475072197
  • Unit Cell Volume: 446.9274070676846
  • Molar Volume: 8.410811733948174
  • Full Formula: Al2 Pb6 S2 O22
  • Reduced Formula: AlPb3SO11
  • Formula Anonymous: ABC3D11
  • Spacegroup Number: 161
  • Spacegroup Symbol: R3cH
  • Crystal System: trigonal
  • Pointgroup: 3m

Thermodynamics:

  • Final energy: -194.02701722
  • Final energy per atom: -6.063344288125
  • 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.