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  1. Third-Parties
  2. MatprojStructure
  3. mp-567545

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-567545
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 3
  • Element list: ['K', 'In', 'Au']
  • Chemical System: Au-In-K
  • Density: 9.37599155540384
  • Atomic Density: 0.040973031643392194
  • Unit Cell Volume: 268.4692725629443
  • Molar Volume: 14.697815900989603
  • Full Formula: K1 In6 Au4
  • Reduced Formula: K(In3Au2)2
  • Formula Anonymous: AB4C6
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2

Thermodynamics:

  • Final energy: -33.61514918
  • Final energy per atom: -3.055922652727273
  • 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.