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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21680
  • 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: 10
  • Number of elements: 2
  • Element list: ['Ca', 'Hg']
  • Chemical System: Ca-Hg
  • Density: 5.81919358681838
  • Atomic Density: 0.03360477749122581
  • Unit Cell Volume: 297.57673600460515
  • Molar Volume: 17.920489911210925
  • Full Formula: Ca6 Hg4
  • Reduced Formula: Ca3Hg2
  • Formula Anonymous: A2B3
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm