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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12961
  • 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: 12
  • Number of elements: 3
  • Element list: ['Hg', 'P', 'Cl']
  • Chemical System: Cl-Hg-P
  • Density: 6.437395369329215
  • Atomic Density: 0.04392399655351262
  • Unit Cell Volume: 273.1991836257522
  • Molar Volume: 13.710366160928057
  • Full Formula: Hg4 P6 Cl2
  • Reduced Formula: Hg2P3Cl
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m