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  1. Third-Parties
  2. MatprojStructure
  3. mp-867534

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-867534
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 3
  • Element list: ['Li', 'Ag', 'F']
  • Chemical System: Ag-F-Li
  • Density: 4.880864418328973
  • Atomic Density: 0.06888943324153485
  • Unit Cell Volume: 406.44840119134886
  • Molar Volume: 8.741748155897337
  • Full Formula: Li4 Ag8 F16
  • Reduced Formula: LiAg2F4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 68
  • Spacegroup Symbol: Ccce1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -111.565728
  • Final energy per atom: -3.9844902857142857
  • 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.