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  1. Third-Parties
  2. MatprojStructure
  3. mp-1221119

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-1221119
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 6
  • Element list: ['Na', 'Ca', 'Mg', 'Fe', 'Si', 'O']
  • Chemical System: Ca-Fe-Mg-Na-O-Si
  • Density: 3.234459393663135
  • Atomic Density: 0.08847235671760381
  • Unit Cell Volume: 452.1186219519005
  • Molar Volume: 6.806804954028927
  • Full Formula: Na1 Ca3 Mg3 Fe1 Si8 O24
  • Reduced Formula: NaCa3Mg3Fe(SiO3)8
  • Formula Anonymous: ABC3D3E8F24
  • Spacegroup Number: 3
  • Spacegroup Symbol: P121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -310.45471294000004
  • Final energy per atom: -7.7613678235000005
  • 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.