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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12525
  • 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: 14
  • Number of elements: 3
  • Element list: ['Hg', 'S', 'Cl']
  • Chemical System: Cl-Hg-S
  • Density: 6.594209523888969
  • Atomic Density: 0.037727543718781766
  • Unit Cell Volume: 371.08167190408506
  • Molar Volume: 15.96218615473241
  • Full Formula: Hg6 S4 Cl4
  • Reduced Formula: Hg3(SCl)2
  • Formula Anonymous: A2B2C3
  • Spacegroup Number: 199
  • Spacegroup Symbol: I2_13
  • Crystal System: cubic
  • Pointgroup: 23