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  1. Third-Parties
  2. MatprojStructure
  3. mp-1196631

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-1196631
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 48
  • Number of elements: 3
  • Element list: ['Na', 'S', 'O']
  • Chemical System: Na-O-S
  • Density: 2.1204456225363244
  • Atomic Density: 0.06901281692985045
  • Unit Cell Volume: 695.5229787068483
  • Molar Volume: 8.726119332473175
  • Full Formula: Na8 S4 O36
  • Reduced Formula: Na2SO9
  • Formula Anonymous: AB2C9
  • Spacegroup Number: 95
  • Spacegroup Symbol: P4_322
  • Crystal System: tetragonal
  • Pointgroup: 422

Thermodynamics:

  • Final energy: -238.3704468
  • Final energy per atom: -4.966050975
  • 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.