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  1. Third-Parties
  2. MatprojStructure
  3. mp-19432

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-19432
  • 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: 20
  • Number of elements: 4
  • Element list: ['K', 'Na', 'V', 'O']
  • Chemical System: K-Na-O-V
  • Density: 2.6996390069957013
  • Atomic Density: 0.06253707878127873
  • Unit Cell Volume: 319.81026919964245
  • Molar Volume: 9.629712288068697
  • Full Formula: K2 Na2 V4 O12
  • Reduced Formula: KNaV2O6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -148.75513559
  • Final energy per atom: -7.437756779500001
  • 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.