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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200250

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-1200250
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 6
  • Element list: ['Na', 'Li', 'Ni', 'P', 'O', 'F']
  • Chemical System: F-Li-Na-Ni-O-P
  • Density: 3.425180853638053
  • Atomic Density: 0.09163269946962227
  • Unit Cell Volume: 392.8728522500266
  • Molar Volume: 6.572043380645398
  • Full Formula: Na4 Li4 Ni4 P4 O16 F4
  • Reduced Formula: NaLiNiPO4F
  • Formula Anonymous: ABCDEF4
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -234.81581025
  • Final energy per atom: -6.5226613958333335
  • 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.