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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-120218
  • 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: 2
  • Number of elements: 2
  • Element list: ['H', 'Cl']
  • Chemical System: Cl-H
  • Density: 1.9621940333247334
  • Atomic Density: 0.06481790470128988
  • Unit Cell Volume: 30.855671889069868
  • Molar Volume: 9.290859968017692
  • Full Formula: H1 Cl1
  • Reduced Formula: HCl
  • Formula Anonymous: AB
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2