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  1. Third-Parties
  2. MatprojStructure
  3. mp-1204600

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-1204600
  • 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: 60
  • Number of elements: 4
  • Element list: ['K', 'Ti', 'Ge', 'O']
  • Chemical System: Ge-K-O-Ti
  • Density: 2.81532686281673
  • Atomic Density: 0.060073972044452924
  • Unit Cell Volume: 998.7686506828917
  • Molar Volume: 10.024542335146073
  • Full Formula: K6 Ti8 Ge6 O40
  • Reduced Formula: K3Ti4Ge3O20
  • Formula Anonymous: A3B3C4D20
  • Spacegroup Number: 117
  • Spacegroup Symbol: P-4b2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -423.00761699
  • Final energy per atom: -7.0501269498333325
  • 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.