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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103668
  • 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: ['Zn', 'Ni', 'O']
  • Chemical System: Ni-O-Zn
  • Density: 6.713677848234337
  • Atomic Density: 0.10213662024608626
  • Unit Cell Volume: 58.744845732546274
  • Molar Volume: 5.896162165431317
  • Full Formula: Zn2 Ni1 O3
  • Reduced Formula: Zn2NiO3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm