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  1. Third-Parties
  2. MatprojStructure
  3. mp-758917

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-758917
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 70
  • Number of elements: 4
  • Element list: ['Li', 'Mn', 'Fe', 'O']
  • Chemical System: Fe-Li-Mn-O
  • Density: 3.96944982721516
  • Atomic Density: 0.09952181906435748
  • Unit Cell Volume: 703.3633494453444
  • Molar Volume: 6.051075851121331
  • Full Formula: Li16 Mn12 Fe6 O36
  • Reduced Formula: Li8Mn6(FeO6)3
  • Formula Anonymous: A3B6C8D18
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -506.70023708
  • Final energy per atom: -7.238574815428572
  • 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.