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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-112112
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 56
  • Number of elements: 4
  • Element list: ['Ge', 'La', 'Se', 'Tl']
  • Chemical System: Ge-La-Se-Tl
  • Density: 5.914799738485932
  • Atomic Density: 0.03407337214360492
  • Unit Cell Volume: 1643.5121174383205
  • Molar Volume: 17.674038057105744
  • Full Formula: La8 Tl8 Ge8 Se32
  • Reduced Formula: LaTlGeSe4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm