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  1. Third-Parties
  2. MatprojStructure
  3. mp-759216

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-759216
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 13
  • Number of elements: 4
  • Element list: ['Li', 'Y', 'W', 'O']
  • Chemical System: Li-O-W-Y
  • Density: 4.904352679892009
  • Atomic Density: 0.06557732314095462
  • Unit Cell Volume: 198.2392598132934
  • Molar Volume: 9.183267128875878
  • Full Formula: Li1 Y3 W1 O8
  • Reduced Formula: LiY3WO8
  • Formula Anonymous: ABC3D8
  • Spacegroup Number: 21
  • Spacegroup Symbol: C222
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -115.80951734
  • Final energy per atom: -8.90842441076923
  • 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.