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  1. Third-Parties
  2. MatprojStructure
  3. mp-1229147

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-1229147
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 5
  • Element list: ['Al', 'Fe', 'B', 'Pb', 'O']
  • Chemical System: Al-B-Fe-O-Pb
  • Density: 6.101853549060856
  • Atomic Density: 0.07953189666211025
  • Unit Cell Volume: 352.06000579814497
  • Molar Volume: 7.571981824581591
  • Full Formula: Al2 Fe2 B4 Pb4 O16
  • Reduced Formula: AlFeB2(PbO4)2
  • Formula Anonymous: ABC2D2E8
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -212.3233922
  • Final energy per atom: -7.582978292857143
  • 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.