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  1. Third-Parties
  2. MatprojStructure
  3. mp-766215

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-766215
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 60
  • Number of elements: 5
  • Element list: ['Na', 'Li', 'Fe', 'Si', 'O']
  • Chemical System: Fe-Li-Na-O-Si
  • Density: 3.4114991271632458
  • Atomic Density: 0.0899783830453137
  • Unit Cell Volume: 666.8268307264824
  • Molar Volume: 6.6928750619659505
  • Full Formula: Na5 Li1 Fe6 Si12 O36
  • Reduced Formula: Na5LiFe6(SiO3)12
  • Formula Anonymous: AB5C6D12E36
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -466.46587378
  • Final energy per atom: -7.774431229666666
  • 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.