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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-48414
  • 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: 16
  • Number of elements: 3
  • Element list: ['Cr', 'O', 'F']
  • Chemical System: Cr-F-O
  • Density: 3.938805436107336
  • Atomic Density: 0.08765594669425142
  • Unit Cell Volume: 182.53182588751048
  • Molar Volume: 6.870202179215
  • Full Formula: Cr4 O1 F11
  • Reduced Formula: Cr4OF11
  • Formula Anonymous: AB4C11
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1