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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29951
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 14
  • Number of elements: 3
  • Element list: ['Cu', 'Hg', 'I']
  • Chemical System: Cu-Hg-I
  • Density: 5.238667149944031
  • Atomic Density: 0.026437922734835428
  • Unit Cell Volume: 529.5423600566456
  • Molar Volume: 22.7784187903123
  • Full Formula: Cu4 Hg2 I8
  • Reduced Formula: Cu2HgI4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 66
  • Spacegroup Symbol: Cccm
  • Crystal System: orthorhombic
  • Pointgroup: mmm