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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109915
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 4
  • Element list: ['Ba', 'Na', 'H', 'Ir']
  • Chemical System: Ba-H-Ir-Na
  • Density: 5.04166366807278
  • Atomic Density: 0.07620430604768712
  • Unit Cell Volume: 118.10356221035569
  • Molar Volume: 7.902625287646431
  • Full Formula: Ba1 Na1 H6 Ir1
  • Reduced Formula: BaNaH6Ir
  • Formula Anonymous: ABCD6
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m