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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-26670
  • 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: 8
  • Number of elements: 2
  • Element list: ['Ba', 'Sn']
  • Chemical System: Ba-Sn
  • Density: 6.375154919957026
  • Atomic Density: 0.03112091250751756
  • Unit Cell Volume: 257.06187111536406
  • Molar Volume: 19.35078464857126
  • Full Formula: Ba2 Sn6
  • Reduced Formula: BaSn3
  • Formula Anonymous: AB3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm