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  1. Third-Parties
  2. MatprojStructure
  3. mp-766955

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-766955
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 75
  • Number of elements: 6
  • Element list: ['K', 'Na', 'Mn', 'H', 'W', 'O']
  • Chemical System: H-K-Mn-Na-O-W
  • Density: 3.623227517436476
  • Atomic Density: 0.08026957572582254
  • Unit Cell Volume: 934.3515188890262
  • Molar Volume: 7.502395154759353
  • Full Formula: K6 Na2 Mn1 H24 W6 O36
  • Reduced Formula: K6Na2MnH24(WO6)6
  • Formula Anonymous: AB2C6D6E24F36
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -488.7493960400001
  • Final energy per atom: -6.516658613866667
  • 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.