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  1. Third-Parties
  2. MatprojStructure
  3. mp-1197770

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-1197770
  • 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: 64
  • Number of elements: 2
  • Element list: ['W', 'O']
  • Chemical System: O-W
  • Density: 7.031772651678503
  • Atomic Density: 0.06989911725060169
  • Unit Cell Volume: 915.6052682403381
  • Molar Volume: 8.615474696782616
  • Full Formula: W17 O47
  • Reduced Formula: W17O47
  • Formula Anonymous: A17B47
  • Spacegroup Number: 10
  • Spacegroup Symbol: P12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -590.32379931
  • Final energy per atom: -9.22380936421875
  • 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.