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  1. Third-Parties
  2. MatprojStructure
  3. mp-1193263

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-1193263
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 30
  • Number of elements: 5
  • Element list: ['Ba', 'Mn', 'Fe', 'Si', 'O']
  • Chemical System: Ba-Fe-Mn-O-Si
  • Density: 4.264371653080291
  • Atomic Density: 0.07654992362194504
  • Unit Cell Volume: 391.90110950547984
  • Molar Volume: 7.866945484807245
  • Full Formula: Ba2 Mn4 Fe2 Si4 O18
  • Reduced Formula: BaMn2FeSi2O9
  • Formula Anonymous: ABC2D2E9
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -248.42525302
  • Final energy per atom: -8.280841767333333
  • 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.