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  1. Third-Parties
  2. MatprojStructure
  3. mp-8871

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-8871
  • 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: 14
  • Number of elements: 4
  • Element list: ['Cs', 'Na', 'B', 'O']
  • Chemical System: B-Cs-Na-O
  • Density: 3.7495894311140185
  • Atomic Density: 0.06649884339763097
  • Unit Cell Volume: 210.52997743564893
  • Molar Volume: 9.056008273693584
  • Full Formula: Cs2 Na4 B2 O6
  • Reduced Formula: CsNa2BO3
  • Formula Anonymous: ABC2D3
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -81.36574073
  • Final energy per atom: -5.811838623571428
  • 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.