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  1. Third-Parties
  2. MatprojStructure
  3. mp-1224396

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-1224396
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ge', 'As', 'W']
  • Chemical System: As-Ge-W
  • Density: 10.65826549694284
  • Atomic Density: 0.05810374038829834
  • Unit Cell Volume: 103.26357580257184
  • Molar Volume: 10.364463147733625
  • Full Formula: Ge2 As2 W2
  • Reduced Formula: GeAsW
  • Formula Anonymous: ABC
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -44.64784496
  • Final energy per atom: -7.441307493333333
  • 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.