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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22891
  • 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: 32
  • Number of elements: 3
  • Element list: ['K', 'Er', 'F']
  • Chemical System: Er-F-K
  • Density: 4.460673969990664
  • Atomic Density: 0.06312350042371279
  • Unit Cell Volume: 506.94273583058424
  • Molar Volume: 9.54025160134773
  • Full Formula: K8 Er4 F20
  • Reduced Formula: K2ErF5
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm