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  1. Third-Parties
  2. MatprojStructure
  3. mp-1250723

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-1250723
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 76
  • Number of elements: 4
  • Element list: ['Al', 'Fe', 'Si', 'O']
  • Chemical System: Al-Fe-O-Si
  • Density: 4.096490394207273
  • Atomic Density: 0.09956610175837817
  • Unit Cell Volume: 763.311997334523
  • Molar Volume: 6.048384594401633
  • Full Formula: Al4 Fe12 Si12 O48
  • Reduced Formula: AlFe3(SiO4)3
  • Formula Anonymous: AB3C3D12
  • Spacegroup Number: 206
  • Spacegroup Symbol: Ia-3
  • Crystal System: cubic
  • Pointgroup: m-3

Thermodynamics:

  • Final energy: -603.85867609
  • Final energy per atom: -7.945508895921053
  • 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.