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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102737
  • 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: 3
  • Element list: ['K', 'Na', 'Cl']
  • Chemical System: Cl-K-Na
  • Density: 2.035418816871845
  • Atomic Density: 0.034368844577291266
  • Unit Cell Volume: 290.9611924110873
  • Molar Volume: 17.522092563970116
  • Full Formula: K4 Na1 Cl5
  • Reduced Formula: K4NaCl5
  • Formula Anonymous: AB4C5
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm