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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-684236
  • Created at: Sept. 4, 2022, 3:52 p.m.
  • Last updated at: Sept. 4, 2022, 3:52 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 84
  • Number of elements: 5
  • Element list: ['Cs', 'H', 'Na', 'O', 'S']
  • Chemical System: Cs-H-Na-O-S
  • Density: 2.888195800797612
  • Atomic Density: 0.07769797670324419
  • Unit Cell Volume: 1081.1092330090582
  • Molar Volume: 7.7507047358526036
  • Full Formula: Cs4 Na8 H12 S12 O48
  • Reduced Formula: CsNa2H3(SO4)3
  • Formula Anonymous: AB2C3D3E12
  • Spacegroup Number: 198
  • Spacegroup Symbol: P2_13
  • Crystal System: cubic
  • Pointgroup: 23