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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-80697
  • 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: 4
  • Number of elements: 3
  • Element list: ['K', 'Na', 'Hg']
  • Chemical System: Hg-K-Na
  • Density: 3.0439480442970717
  • Atomic Density: 0.02429757325128424
  • Unit Cell Volume: 164.62549402083113
  • Molar Volume: 24.784947441949583
  • Full Formula: K2 Na1 Hg1
  • Reduced Formula: K2NaHg
  • Formula Anonymous: ABC2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm