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  1. Third-Parties
  2. MatprojStructure
  3. mp-1223005

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-1223005
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 84
  • Number of elements: 5
  • Element list: ['Li', 'Fe', 'Ni', 'P', 'O']
  • Chemical System: Fe-Li-Ni-O-P
  • Density: 3.661292368971279
  • Atomic Density: 0.09667124355936733
  • Unit Cell Volume: 868.9243761348149
  • Molar Volume: 6.2295058367607625
  • Full Formula: Li12 Fe4 Ni8 P12 O48
  • Reduced Formula: Li3FeNi2(PO4)3
  • Formula Anonymous: AB2C3D3E12
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -607.0930048
  • Final energy per atom: -7.227297676190476
  • 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.