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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-89538
  • 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: 30
  • Number of elements: 5
  • Element list: ['Hg', 'H', 'C', 'Br', 'N']
  • Chemical System: Br-C-H-Hg-N
  • Density: 3.686749659318177
  • Atomic Density: 0.06846962364443232
  • Unit Cell Volume: 438.15050241537995
  • Molar Volume: 8.795346665367127
  • Full Formula: Hg2 H16 C4 Br6 N2
  • Reduced Formula: HgH8C2Br3N
  • Formula Anonymous: ABC2D3E8
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m