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  1. Third-Parties
  2. MatprojStructure
  3. mp-680682

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-680682
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 64
  • Number of elements: 2
  • Element list: ['K', 'Ga']
  • Chemical System: Ga-K
  • Density: 4.403086545133823
  • Atomic Density: 0.041443649454074256
  • Unit Cell Volume: 1544.265547147858
  • Molar Volume: 14.53091327459815
  • Full Formula: K12 Ga52
  • Reduced Formula: K3Ga13
  • Formula Anonymous: A3B13
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -180.75301799
  • Final energy per atom: -2.82426590609375
  • 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.