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  1. Third-Parties
  2. MatprojStructure
  3. mp-1042328

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-1042328
  • Created at: Sept. 4, 2022, 2:47 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', 'Mo', 'W', 'O']
  • Chemical System: Mo-O-W-Y
  • Density: 7.249395312711121
  • Atomic Density: 0.07698256331048241
  • Unit Cell Volume: 311.7589096534022
  • Molar Volume: 7.82273348798713
  • Full Formula: Y2 Mo2 W4 O16
  • Reduced Formula: YMo(WO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -225.34308463
  • Final energy per atom: -9.389295192916666
  • 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.