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  1. Third-Parties
  2. MatprojStructure
  3. mp-1223666

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-1223666
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 5
  • Number of elements: 2
  • Element list: ['Ir', 'W']
  • Chemical System: Ir-W
  • Density: 21.26848501446833
  • Atomic Density: 0.06721986723809459
  • Unit Cell Volume: 74.38277112761715
  • Molar Volume: 8.958870356987488
  • Full Formula: Ir4 W1
  • Reduced Formula: Ir4W
  • Formula Anonymous: AB4
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -48.59256957
  • Final energy per atom: -9.718513914
  • 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.