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  1. Third-Parties
  2. MatprojStructure
  3. mp-1202382

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-1202382
  • 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: 62
  • Number of elements: 4
  • Element list: ['Mn', 'Fe', 'C', 'O']
  • Chemical System: C-Fe-Mn-O
  • Density: 1.7014390135700002
  • Atomic Density: 0.05693794941693693
  • Unit Cell Volume: 1088.9046872059866
  • Molar Volume: 10.576673065448746
  • Full Formula: Mn4 Fe2 C28 O28
  • Reduced Formula: Mn2Fe(CO)14
  • Formula Anonymous: AB2C14D14
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -495.8251761
  • Final energy per atom: -7.997180259677419
  • 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.