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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-50215
  • 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: 15
  • Number of elements: 3
  • Element list: ['Ba', 'Hf', 'O']
  • Chemical System: Ba-Hf-O
  • Density: 5.892386812188399
  • Atomic Density: 0.04708505997577198
  • Unit Cell Volume: 318.57238809334376
  • Molar Volume: 12.789918422316427
  • Full Formula: Ba6 Hf1 O8
  • Reduced Formula: Ba6HfO8
  • Formula Anonymous: AB6C8
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m