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  1. Third-Parties
  2. MatprojStructure
  3. mp-1221991

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-1221991
  • 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: 20
  • Number of elements: 2
  • Element list: ['Mn', 'Fe']
  • Chemical System: Fe-Mn
  • Density: 8.256018471108781
  • Atomic Density: 0.09005395208551327
  • Unit Cell Volume: 222.089087006514
  • Molar Volume: 6.687258716065571
  • Full Formula: Mn14 Fe6
  • Reduced Formula: Mn7Fe3
  • Formula Anonymous: A3B7
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -177.33831723000003
  • Final energy per atom: -8.8669158615
  • 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.