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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97335
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['Ba', 'Sn', 'As']
  • Chemical System: As-Ba-Sn
  • Density: 5.194667555692638
  • Atomic Density: 0.02966504171200382
  • Unit Cell Volume: 1213.549616733988
  • Molar Volume: 20.300462808933688
  • Full Formula: Ba12 Sn8 As16
  • Reduced Formula: Ba3(SnAs2)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m