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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97654
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 60
  • Number of elements: 3
  • Element list: ['Nb', 'Ni', 'O']
  • Chemical System: Nb-Ni-O
  • Density: 5.845644848419809
  • Atomic Density: 0.09352944559709858
  • Unit Cell Volume: 641.5092019091503
  • Molar Volume: 6.438764521220273
  • Full Formula: Nb8 Ni16 O36
  • Reduced Formula: Nb2Ni4O9
  • Formula Anonymous: A2B4C9
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm