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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200283

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-1200283
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 80
  • Number of elements: 5
  • Element list: ['Na', 'Sb', 'N', 'O', 'F']
  • Chemical System: F-N-Na-O-Sb
  • Density: 3.0688589692776627
  • Atomic Density: 0.06606308608177983
  • Unit Cell Volume: 1210.9637127906437
  • Molar Volume: 9.115742417096836
  • Full Formula: Na8 Sb8 N8 O32 F24
  • Reduced Formula: NaSbNO4F3
  • Formula Anonymous: ABCD3E4
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -437.03171608
  • Final energy per atom: -5.462896451000001
  • 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.