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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1345479
  • Created at: Sept. 4, 2022, 3:46 p.m.
  • Last updated at: Sept. 4, 2022, 3:46 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 48
  • Number of elements: 3
  • Element list: ['Ba', 'O', 'Sn']
  • Chemical System: Ba-O-Sn
  • Density: 3.523674192279043
  • Atomic Density: 0.03344389467192439
  • Unit Cell Volume: 1435.2395398582337
  • Molar Volume: 18.006696944466487
  • Full Formula: Ba12 Sn8 O28
  • Reduced Formula: Ba3Sn2O7
  • Formula Anonymous: A2B3C7
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m