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  1. Third-Parties
  2. MatprojStructure
  3. mp-6838

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-6838
  • 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: 100
  • Number of elements: 5
  • Element list: ['Na', 'Li', 'Fe', 'Si', 'O']
  • Chemical System: Fe-Li-Na-O-Si
  • Density: 2.6868867327668156
  • Atomic Density: 0.07820299143042007
  • Unit Cell Volume: 1278.723462758755
  • Molar Volume: 7.70065268584784
  • Full Formula: Na8 Li4 Fe4 Si24 O60
  • Reduced Formula: Na2LiFe(Si2O5)3
  • Formula Anonymous: ABC2D6E15
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -765.7207711
  • Final energy per atom: -7.657207711
  • 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.