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  1. Third-Parties
  2. MatprojStructure
  3. mp-1235592

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-1235592
  • 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: 15
  • Number of elements: 4
  • Element list: ['Li', 'Y', 'Fe', 'O']
  • Chemical System: Fe-Li-O-Y
  • Density: 4.804469247083584
  • Atomic Density: 0.08095043205089847
  • Unit Cell Volume: 185.29857864833366
  • Molar Volume: 7.439294154987973
  • Full Formula: Li1 Y2 Fe4 O8
  • Reduced Formula: LiY2(FeO2)4
  • Formula Anonymous: AB2C4D8
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -121.40235444
  • Final energy per atom: -8.093490296
  • 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.