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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34425
  • 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: 23
  • Number of elements: 5
  • Element list: ['Ba', 'Ru', 'Pt', 'Cl', 'O']
  • Chemical System: Ba-Cl-O-Pt-Ru
  • Density: 5.451069532607391
  • Atomic Density: 0.05087468618186977
  • Unit Cell Volume: 452.091240774995
  • Molar Volume: 11.83720473178292
  • Full Formula: Ba6 Ru2 Pt1 Cl2 O12
  • Reduced Formula: Ba6Ru2Pt(ClO6)2
  • Formula Anonymous: AB2C2D6E12
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1