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  1. Third-Parties
  2. MatprojStructure
  3. mp-558082

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-558082
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 32
  • Number of elements: 3
  • Element list: ['Li', 'Ga', 'O']
  • Chemical System: Ga-Li-O
  • Density: 2.010833894286237
  • Atomic Density: 0.07100965359038237
  • Unit Cell Volume: 450.642953204522
  • Molar Volume: 8.480735302186638
  • Full Formula: Li20 Ga4 O8
  • Reduced Formula: Li5GaO2
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 91
  • Spacegroup Symbol: P4_122
  • Crystal System: tetragonal
  • Pointgroup: 422

Thermodynamics:

  • Final energy: -133.56254795
  • Final energy per atom: -4.1738296234375
  • 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.