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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109732
  • 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: 6
  • Number of elements: 3
  • Element list: ['K', 'Na', 'Cl']
  • Chemical System: Cl-K-Na
  • Density: 2.0858214488142655
  • Atomic Density: 0.03631334318728527
  • Unit Cell Volume: 165.22852134696416
  • Molar Volume: 16.58382355196805
  • Full Formula: K2 Na1 Cl3
  • Reduced Formula: K2NaCl3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1