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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117038
  • 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: 30
  • Number of elements: 5
  • Element list: ['Ba', 'Ho', 'Ru', 'Ir', 'O']
  • Chemical System: Ba-Ho-Ir-O-Ru
  • Density: 7.621834770040842
  • Atomic Density: 0.0678861402185348
  • Unit Cell Volume: 441.9164192193853
  • Molar Volume: 8.87094293564769
  • Full Formula: Ba6 Ho2 Ru2 Ir2 O18
  • Reduced Formula: Ba3HoIrRuO9
  • Formula Anonymous: ABCD3E9
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm