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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103739
  • 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: 7
  • Number of elements: 3
  • Element list: ['Al', 'Co', 'F']
  • Chemical System: Al-Co-F
  • Density: 3.6663996591296075
  • Atomic Density: 0.08543463646492558
  • Unit Cell Volume: 81.93398239452668
  • Molar Volume: 7.048828214388593
  • Full Formula: Al1 Co1 F5
  • Reduced Formula: AlCoF5
  • Formula Anonymous: ABC5
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm