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  1. Third-Parties
  2. MatprojStructure
  3. mp-1099932

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-1099932
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 5
  • Element list: ['K', 'Na', 'V', 'Cr', 'O']
  • Chemical System: Cr-K-Na-O-V
  • Density: 3.8118112026118247
  • Atomic Density: 0.09240752019917772
  • Unit Cell Volume: 432.86520311099025
  • Molar Volume: 6.516937958100933
  • Full Formula: K1 Na7 V6 Cr2 O24
  • Reduced Formula: KNa7V6Cr2O24
  • Formula Anonymous: AB2C6D7E24
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -286.98860431
  • Final energy per atom: -7.174715107750001
  • 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.