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  1. Third-Parties
  2. MatprojStructure
  3. mp-772441

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-772441
  • 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: 52
  • Number of elements: 3
  • Element list: ['Y', 'W', 'O']
  • Chemical System: O-W-Y
  • Density: 6.870625107458763
  • Atomic Density: 0.07801262037662973
  • Unit Cell Volume: 666.5588176496846
  • Molar Volume: 7.719444278279949
  • Full Formula: Y8 W8 O36
  • Reduced Formula: Y2W2O9
  • Formula Anonymous: A2B2C9
  • Spacegroup Number: 20
  • Spacegroup Symbol: C222_1
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -483.36381303
  • Final energy per atom: -9.295457942884616
  • 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.