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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12742
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Au', 'Cl', 'O']
  • Chemical System: Au-Cl-O
  • Density: 7.00507309217152
  • Atomic Density: 0.05094482484112206
  • Unit Cell Volume: 353.3234250217819
  • Molar Volume: 11.820907773813758
  • Full Formula: Au6 Cl6 O6
  • Reduced Formula: AuClO
  • Formula Anonymous: ABC
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3