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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-58318
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 20
  • Number of elements: 4
  • Element list: ['Ca', 'Cu', 'Ru', 'O']
  • Chemical System: Ca-Cu-O-Ru
  • Density: 6.641164021713692
  • Atomic Density: 0.09672204644809852
  • Unit Cell Volume: 206.778089737091
  • Molar Volume: 6.2262338124033665
  • Full Formula: Ca1 Cu3 Ru4 O12
  • Reduced Formula: CaCu3(RuO3)4
  • Formula Anonymous: AB3C4D12
  • Spacegroup Number: 204
  • Spacegroup Symbol: Im-3
  • Crystal System: cubic
  • Pointgroup: m-3