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  1. Third-Parties
  2. MatprojStructure
  3. mp-768573

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-768573
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:40 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['Lu', 'Al', 'O']
  • Chemical System: Al-Lu-O
  • Density: 8.667009661654376
  • Atomic Density: 0.08056127319339246
  • Unit Cell Volume: 248.25824130148402
  • Molar Volume: 7.475230369737911
  • Full Formula: Lu6 Al2 O12
  • Reduced Formula: Lu3AlO6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -172.63999176
  • Final energy per atom: -8.631999588
  • 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.