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  1. Third-Parties
  2. MatprojStructure
  3. mp-554364

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-554364
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 4
  • Element list: ['Mg', 'Be', 'Al', 'O']
  • Chemical System: Al-Be-Mg-O
  • Density: 3.515733514569006
  • Atomic Density: 0.1100924828433328
  • Unit Cell Volume: 508.6632488767725
  • Molar Volume: 5.470074436026493
  • Full Formula: Mg4 Be4 Al16 O32
  • Reduced Formula: MgBeAl4O8
  • Formula Anonymous: ABC4D8
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm

Thermodynamics:

  • Final energy: -425.50994828
  • Final energy per atom: -7.5983919335714285
  • 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.