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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-106637
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['K', 'Na', 'Pd', 'F']
  • Chemical System: F-K-Na-Pd
  • Density: 3.5290800389741275
  • Atomic Density: 0.0660846672499487
  • Unit Cell Volume: 151.32103127912418
  • Molar Volume: 9.112765503112488
  • Full Formula: K2 Na1 Pd1 F6
  • Reduced Formula: K2NaPdF6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm