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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116159
  • 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: 3
  • Number of elements: 2
  • Element list: ['Hf', 'Cl']
  • Chemical System: Cl-Hf
  • Density: 8.908710917528987
  • Atomic Density: 0.04101299673119878
  • Unit Cell Volume: 73.14754441530204
  • Molar Volume: 14.683493623910026
  • Full Formula: Hf2 Cl1
  • Reduced Formula: Hf2Cl
  • Formula Anonymous: AB2
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm