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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102444
  • 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: 9
  • Number of elements: 3
  • Element list: ['Au', 'O', 'F']
  • Chemical System: Au-F-O
  • Density: 4.872541376048871
  • Atomic Density: 0.07700356121899588
  • Unit Cell Volume: 116.87771133602853
  • Molar Volume: 7.820600326357905
  • Full Formula: Au1 O2 F6
  • Reduced Formula: Au(OF3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1