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  1. Third-Parties
  2. MatprojStructure
  3. mp-530399

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-530399
  • 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: 56
  • Number of elements: 3
  • Element list: ['Li', 'Al', 'O']
  • Chemical System: Al-Li-O
  • Density: 3.5173109456293474
  • Atomic Density: 0.10989479115624838
  • Unit Cell Volume: 509.57829220840154
  • Molar Volume: 5.479914649856081
  • Full Formula: Li4 Al20 O32
  • Reduced Formula: LiAl5O8
  • Formula Anonymous: AB5C8
  • Spacegroup Number: 212
  • Spacegroup Symbol: P4_332
  • Crystal System: cubic
  • Pointgroup: 432

Thermodynamics:

  • Final energy: -428.68099316
  • Final energy per atom: -7.655017735
  • 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.