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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-93478
  • 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: ['Cr', 'Ir', 'O']
  • Chemical System: Cr-Ir-O
  • Density: 8.275602842605196
  • Atomic Density: 0.09701839399329194
  • Unit Cell Volume: 61.843942710645706
  • Molar Volume: 6.207215469281406
  • Full Formula: Cr1 Ir1 O4
  • Reduced Formula: CrIrO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm