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  1. Third-Parties
  2. MatprojStructure
  3. mp-1233128

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-1233128
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 30
  • Number of elements: 4
  • Element list: ['Mg', 'Fe', 'Ni', 'O']
  • Chemical System: Fe-Mg-Ni-O
  • Density: 5.239431320192239
  • Atomic Density: 0.09249607158066517
  • Unit Cell Volume: 324.338098768197
  • Molar Volume: 6.510698948709551
  • Full Formula: Mg1 Fe7 Ni6 O16
  • Reduced Formula: MgFe7(Ni3O8)2
  • Formula Anonymous: AB6C7D16
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -207.94067944
  • Final energy per atom: -6.931355981333334
  • 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.