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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23980
  • 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: 8
  • Number of elements: 3
  • Element list: ['K', 'H', 'F']
  • Chemical System: F-H-K
  • Density: 2.421491900812924
  • Atomic Density: 0.07468371979372528
  • Unit Cell Volume: 107.1183923630989
  • Molar Volume: 8.063525459943634
  • Full Formula: K2 H2 F4
  • Reduced Formula: KHF2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 140
  • Spacegroup Symbol: I4/mcm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm