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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-87896
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 54
  • Number of elements: 3
  • Element list: ['Ba', 'Na', 'Si']
  • Chemical System: Ba-Na-Si
  • Density: 3.2049420880967676
  • Atomic Density: 0.04820969257963573
  • Unit Cell Volume: 1120.1067069822004
  • Molar Volume: 12.491556029012752
  • Full Formula: Ba6 Na2 Si46
  • Reduced Formula: Ba3NaSi23
  • Formula Anonymous: AB3C23
  • Spacegroup Number: 223
  • Spacegroup Symbol: Pm-3n
  • Crystal System: cubic
  • Pointgroup: m-3m