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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-113122
  • 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: 12
  • Number of elements: 4
  • Element list: ['Ba', 'In', 'Bi', 'O']
  • Chemical System: Ba-Bi-In-O
  • Density: 5.951886411369838
  • Atomic Density: 0.04438302863537743
  • Unit Cell Volume: 270.3736173253142
  • Molar Volume: 13.568566511028473
  • Full Formula: Ba4 In1 Bi1 O6
  • Reduced Formula: Ba4InBiO6
  • Formula Anonymous: ABC4D6
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm