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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-65603
  • 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: 4
  • Number of elements: 3
  • Element list: ['K', 'Ba', 'Bi']
  • Chemical System: Ba-Bi-K
  • Density: 3.811661387850801
  • Atomic Density: 0.02162934758214482
  • Unit Cell Volume: 184.9339183629389
  • Molar Volume: 27.842452191999172
  • Full Formula: K2 Ba1 Bi1
  • Reduced Formula: K2BaBi
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm