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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-88458
  • 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: 5
  • Element list: ['Fe', 'Hg', 'C', 'S', 'N']
  • Chemical System: C-Fe-Hg-N-S
  • Density: 3.052992032779358
  • Atomic Density: 0.05266291149905961
  • Unit Cell Volume: 265.84173949915385
  • Molar Volume: 11.43525982247969
  • Full Formula: Fe1 Hg1 C4 S4 N4
  • Reduced Formula: FeHgC4(SN)4
  • Formula Anonymous: ABC4D4E4
  • Spacegroup Number: 82
  • Spacegroup Symbol: I-4
  • Crystal System: tetragonal
  • Pointgroup: -4