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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-4999
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['La', 'O', 'Ta']
  • Chemical System: La-O-Ta
  • Density: 7.849571853351278
  • Atomic Density: 0.07388997206798847
  • Unit Cell Volume: 162.40363427067513
  • Molar Volume: 8.150146212613045
  • Full Formula: La2 Ta2 O8
  • Reduced Formula: LaTaO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2