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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111322
  • 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: 5
  • Number of elements: 3
  • Element list: ['K', 'Pa', 'O']
  • Chemical System: K-O-Pa
  • Density: 6.311004863963449
  • Atomic Density: 0.05973261766212939
  • Unit Cell Volume: 83.70636003735713
  • Molar Volume: 10.081829653044071
  • Full Formula: K1 Pa1 O3
  • Reduced Formula: KPaO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m