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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-108790
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Cu', 'Ni', 'O']
  • Chemical System: Cu-Ni-O
  • Density: 6.899411209802421
  • Atomic Density: 0.10947554303953934
  • Unit Cell Volume: 73.07568227463038
  • Molar Volume: 5.500900559885764
  • Full Formula: Cu1 Ni3 O4
  • Reduced Formula: CuNi3O4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m