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  1. Third-Parties
  2. MatprojStructure
  3. mp-1212935

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-1212935
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 3
  • Element list: ['Ga', 'Pb', 'F']
  • Chemical System: F-Ga-Pb
  • Density: 6.044516523962935
  • Atomic Density: 0.06851202410773612
  • Unit Cell Volume: 817.3747707692771
  • Molar Volume: 8.789903434366643
  • Full Formula: Ga8 Pb8 F40
  • Reduced Formula: GaPbF5
  • Formula Anonymous: ABC5
  • Spacegroup Number: 79
  • Spacegroup Symbol: I4
  • Crystal System: tetragonal
  • Pointgroup: 4

Thermodynamics:

  • Final energy: -289.05535609000003
  • Final energy per atom: -5.161702787321429
  • 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.