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  1. Third-Parties
  2. MatprojStructure
  3. mp-1207646

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-1207646
  • 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: 24
  • Number of elements: 4
  • Element list: ['Y', 'Tl', 'W', 'O']
  • Chemical System: O-Tl-W-Y
  • Density: 7.843242418162665
  • Atomic Density: 0.07184067549815315
  • Unit Cell Volume: 334.0725826083996
  • Molar Volume: 8.382633818852128
  • Full Formula: Y2 Tl2 W4 O16
  • Reduced Formula: YTl(WO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -208.63900921000004
  • Final energy per atom: -8.693292050416668
  • 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.