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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85684
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['Hg', 'H', 'N', 'Cl']
  • Chemical System: Cl-H-Hg-N
  • Density: 5.451759796814231
  • Atomic Density: 0.06512445074307661
  • Unit Cell Volume: 153.55215876524073
  • Molar Volume: 9.247127140861476
  • Full Formula: Hg2 H4 N2 Cl2
  • Reduced Formula: HgH2NCl
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 51
  • Spacegroup Symbol: Pmma
  • Crystal System: orthorhombic
  • Pointgroup: mmm