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  1. Third-Parties
  2. MatprojStructure
  3. mp-1043944

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-1043944
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 4
  • Element list: ['La', 'Fe', 'Mo', 'O']
  • Chemical System: Fe-La-Mo-O
  • Density: 5.339832416637893
  • Atomic Density: 0.07484479680684655
  • Unit Cell Volume: 240.4976801053112
  • Molar Volume: 8.04617156693131
  • Full Formula: La2 Fe2 Mo2 O12
  • Reduced Formula: LaFeMoO6
  • Formula Anonymous: ABCD6
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -151.10897699000003
  • Final energy per atom: -8.394943166111112
  • 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.