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  1. Third-Parties
  2. MatprojStructure
  3. mp-559730

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-559730
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 88
  • Number of elements: 4
  • Element list: ['K', 'Ga', 'Te', 'O']
  • Chemical System: Ga-K-O-Te
  • Density: 5.3742152194016874
  • Atomic Density: 0.06482208756042689
  • Unit Cell Volume: 1357.561956300262
  • Molar Volume: 9.290260444614939
  • Full Formula: K4 Ga4 Te24 O56
  • Reduced Formula: KGa(Te3O7)2
  • Formula Anonymous: ABC6D14
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3

Thermodynamics:

  • Final energy: -513.9416815
  • Final energy per atom: -5.840246380681818
  • 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.