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  1. Third-Parties
  2. MatprojStructure
  3. mp-1236720

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-1236720
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 4
  • Element list: ['Li', 'Lu', 'Al', 'O']
  • Chemical System: Al-Li-Lu-O
  • Density: 6.175015872105612
  • Atomic Density: 0.08070780128233872
  • Unit Cell Volume: 136.29413545189874
  • Molar Volume: 7.461658804125822
  • Full Formula: Li1 Lu2 Al2 O6
  • Reduced Formula: LiLu2Al2O6
  • Formula Anonymous: AB2C2D6
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1

Thermodynamics:

  • Final energy: -84.47904316
  • Final energy per atom: -7.679913014545455
  • 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.