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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-59030
  • 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: 64
  • Number of elements: 3
  • Element list: ['Br', 'Cs', 'Tl']
  • Chemical System: Br-Cs-Tl
  • Density: 4.565371250457945
  • Atomic Density: 0.02528951067492368
  • Unit Cell Volume: 2530.693488801287
  • Molar Volume: 23.812800640588804
  • Full Formula: Cs16 Tl8 Br40
  • Reduced Formula: Cs2TlBr5
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm