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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-4125
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Ac', 'Cl', 'O']
  • Chemical System: Ac-Cl-O
  • Density: 7.172188680643356
  • Atomic Density: 0.04653426920404262
  • Unit Cell Volume: 128.93723491587048
  • Molar Volume: 12.94130296447598
  • Full Formula: Ac2 Cl2 O2
  • Reduced Formula: AcClO
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm