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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-33034
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 29
  • Number of elements: 4
  • Element list: ['Hg', 'H', 'Cl', 'O']
  • Chemical System: Cl-H-Hg-O
  • Density: 2.8775263326206333
  • Atomic Density: 0.09900593771552324
  • Unit Cell Volume: 292.91172498488504
  • Molar Volume: 6.082605648666851
  • Full Formula: Hg1 H12 Cl2 O14
  • Reduced Formula: HgH12(ClO7)2
  • Formula Anonymous: AB2C12D14
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1