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  1. Third-Parties
  2. MatprojStructure
  3. mp-849732

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-849732
  • 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: 17
  • Number of elements: 4
  • Element list: ['Li', 'Sb', 'Te', 'O']
  • Chemical System: Li-O-Sb-Te
  • Density: 5.313132253966406
  • Atomic Density: 0.07731970281130607
  • Unit Cell Volume: 219.86633913334413
  • Molar Volume: 7.788623780275851
  • Full Formula: Li1 Sb1 Te3 O12
  • Reduced Formula: LiSb(TeO4)3
  • Formula Anonymous: ABC3D12
  • Spacegroup Number: 3
  • Spacegroup Symbol: P121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -101.40668298
  • Final energy per atom: -5.965098998823529
  • 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.