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  1. Third-Parties
  2. MatprojStructure
  3. mp-1215938

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-1215938
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 80
  • Number of elements: 4
  • Element list: ['Yb', 'Y', 'Al', 'O']
  • Chemical System: Al-O-Y-Yb
  • Density: 5.377402055702404
  • Atomic Density: 0.08997667484984376
  • Unit Cell Volume: 889.1193204628512
  • Molar Volume: 6.693002125328547
  • Full Formula: Yb6 Y6 Al20 O48
  • Reduced Formula: Yb3Y3Al10O24
  • Formula Anonymous: A3B3C10D24
  • Spacegroup Number: 214
  • Spacegroup Symbol: I4_132
  • Crystal System: cubic
  • Pointgroup: 432

Thermodynamics:

  • Final energy: -636.40518093
  • Final energy per atom: -7.9550647616250005
  • 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.