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  1. Third-Parties
  2. MatprojStructure
  3. mp-771170

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-771170
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 4
  • Element list: ['Li', 'Zn', 'Fe', 'O']
  • Chemical System: Fe-Li-O-Zn
  • Density: 4.655573717876873
  • Atomic Density: 0.09103416561345251
  • Unit Cell Volume: 615.1536582186748
  • Molar Volume: 6.615253426467483
  • Full Formula: Li3 Zn2 Fe19 O32
  • Reduced Formula: Li3Zn2Fe19O32
  • Formula Anonymous: A2B3C19D32
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -422.75509143
  • Final energy per atom: -7.54919806125
  • 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.