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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-39489
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 21
  • Number of elements: 3
  • Element list: ['K', 'Hf', 'O']
  • Chemical System: Hf-K-O
  • Density: 6.812416060663218
  • Atomic Density: 0.06943156850628912
  • Unit Cell Volume: 302.45607944314
  • Molar Volume: 8.67349087678253
  • Full Formula: K4 Hf5 O12
  • Reduced Formula: K4Hf5O12
  • Formula Anonymous: A4B5C12
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1