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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34651
  • 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: 16
  • Number of elements: 3
  • Element list: ['K', 'Sb', 'F']
  • Chemical System: F-K-Sb
  • Density: 3.4162310291485865
  • Atomic Density: 0.05988173914203796
  • Unit Cell Volume: 267.1933084984123
  • Molar Volume: 10.056723211922145
  • Full Formula: K2 Sb2 F12
  • Reduced Formula: KSbF6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 132
  • Spacegroup Symbol: P4_2/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm