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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-4081
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 2
  • Element list: ['Cl', 'Ru']
  • Chemical System: Cl-Ru
  • Density: 3.6485672394441737
  • Atomic Density: 0.042370518096988476
  • Unit Cell Volume: 188.81053051292776
  • Molar Volume: 14.213044896489075
  • Full Formula: Ru2 Cl6
  • Reduced Formula: RuCl3
  • Formula Anonymous: AB3
  • Spacegroup Number: 193
  • Spacegroup Symbol: P6_3/mcm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm