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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222874

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-1222874
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 4
  • Element list: ['La', 'Pr', 'Al', 'O']
  • Chemical System: Al-La-O-Pr
  • Density: 6.513560808446303
  • Atomic Density: 0.09105844023529429
  • Unit Cell Volume: 219.63916742171466
  • Molar Volume: 6.61348991311386
  • Full Formula: La1 Pr3 Al4 O12
  • Reduced Formula: LaPr3Al4O12
  • Formula Anonymous: AB3C4D12
  • Spacegroup Number: 111
  • Spacegroup Symbol: P-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m

Thermodynamics:

  • Final energy: -167.05452170999996
  • Final energy per atom: -8.352726085499999
  • 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.