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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98831
  • 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: 20
  • Number of elements: 3
  • Element list: ['Hg', 'C', 'N']
  • Chemical System: C-Hg-N
  • Density: 4.1774149930047555
  • Atomic Density: 0.04979119450961023
  • Unit Cell Volume: 401.6774491349025
  • Molar Volume: 12.094790694040615
  • Full Formula: Hg4 C8 N8
  • Reduced Formula: Hg(CN)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 122
  • Spacegroup Symbol: I-42d
  • Crystal System: tetragonal
  • Pointgroup: -42m