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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1745533
  • Created at: Sept. 4, 2022, 4:02 p.m.
  • Last updated at: Sept. 4, 2022, 4:02 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 12
  • Number of elements: 2
  • Element list: ['H', 'Ni']
  • Chemical System: H-Ni
  • Density: 5.686791665996531
  • Atomic Density: 0.16923274282248577
  • Unit Cell Volume: 70.9082639674949
  • Molar Volume: 3.55849622216242
  • Full Formula: Ni4 H8
  • Reduced Formula: NiH2
  • Formula Anonymous: AB2
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm