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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111633
  • 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: 13
  • Number of elements: 3
  • Element list: ['K', 'Fe', 'O']
  • Chemical System: Fe-K-O
  • Density: 4.735099253942893
  • Atomic Density: 0.08963379688434296
  • Unit Cell Volume: 145.03457905252267
  • Molar Volume: 6.718605000935685
  • Full Formula: K2 Fe4 O7
  • Reduced Formula: K2Fe4O7
  • Formula Anonymous: A2B4C7
  • Spacegroup Number: 162
  • Spacegroup Symbol: P-31m
  • Crystal System: trigonal
  • Pointgroup: -31m