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  1. Third-Parties
  2. MatprojStructure
  3. mp-766253

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-766253
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 39
  • Number of elements: 3
  • Element list: ['La', 'Th', 'O']
  • Chemical System: La-O-Th
  • Density: 9.237072526365152
  • Atomic Density: 0.06683019321429846
  • Unit Cell Volume: 583.5685657071521
  • Molar Volume: 9.011107809743022
  • Full Formula: La2 Th11 O26
  • Reduced Formula: La2Th11O26
  • Formula Anonymous: A2B11C26
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -383.1945570800001
  • Final energy per atom: -9.825501463589745
  • 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.