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  1. Third-Parties
  2. MatprojStructure
  3. mp-758540

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-758540
  • 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: 54
  • Number of elements: 5
  • Element list: ['Li', 'Fe', 'P', 'O', 'F']
  • Chemical System: F-Fe-Li-O-P
  • Density: 2.712301324935849
  • Atomic Density: 0.09357060789793382
  • Unit Cell Volume: 577.1042981670358
  • Molar Volume: 6.4359320680794445
  • Full Formula: Li14 Fe2 P8 O28 F2
  • Reduced Formula: Li7FeP4O14F
  • Formula Anonymous: ABC4D7E14
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -371.68006076
  • Final energy per atom: -6.882964088148149
  • 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.