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  1. Third-Parties
  2. MatprojStructure
  3. mp-1185234

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-1185234
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Li', 'Ce', 'Al']
  • Chemical System: Al-Ce-Li
  • Density: 5.314919674351759
  • Atomic Density: 0.04075343881484278
  • Unit Cell Volume: 98.15122640750413
  • Molar Volume: 14.777012529815474
  • Full Formula: Li1 Ce2 Al1
  • Reduced Formula: LiCe2Al
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -17.67232706
  • Final energy per atom: -4.418081765
  • 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.