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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-32950
  • 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: 3
  • Element list: ['Bi', 'Cl', 'Cs']
  • Chemical System: Bi-Cl-Cs
  • Density: 3.892778963084609
  • Atomic Density: 0.028897105817483205
  • Unit Cell Volume: 1937.9103344709044
  • Molar Volume: 20.839944311504407
  • Full Formula: Cs12 Bi8 Cl36
  • Reduced Formula: Cs3Bi2Cl9
  • Formula Anonymous: A2B3C9
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm