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  1. Third-Parties
  2. MatprojStructure
  3. mp-1201249

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-1201249
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 70
  • Number of elements: 4
  • Element list: ['Mn', 'Fe', 'Pb', 'F']
  • Chemical System: F-Fe-Mn-Pb
  • Density: 6.973992743009065
  • Atomic Density: 0.06446581154941196
  • Unit Cell Volume: 1085.846874763163
  • Molar Volume: 9.3416038908998
  • Full Formula: Mn2 Fe4 Pb16 F48
  • Reduced Formula: MnFe2Pb8F24
  • Formula Anonymous: AB2C8D24
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -392.26800787
  • Final energy per atom: -5.603828683857143
  • 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.