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  1. Third-Parties
  2. MatprojStructure
  3. mp-779755

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-779755
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 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: 4.034881375093477
  • Atomic Density: 0.09378662965800931
  • Unit Cell Volume: 746.3750457315004
  • Molar Volume: 6.421107978780761
  • Full Formula: Li10 Mn14 Fe6 O40
  • Reduced Formula: Li5Mn7Fe3O20
  • Formula Anonymous: A3B5C7D20
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -535.39076621
  • Final energy per atom: -7.6484395172857145
  • 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.