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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1377167
  • Created at: Sept. 4, 2022, 3:49 p.m.
  • Last updated at: Sept. 4, 2022, 3:49 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['N', 'Si', 'Zr']
  • Chemical System: N-Si-Zr
  • Density: 6.274374549556633
  • Atomic Density: 0.059831302490037486
  • Unit Cell Volume: 167.13659211522432
  • Molar Volume: 10.065200838645872
  • Full Formula: Zr6 Si2 N2
  • Reduced Formula: Zr3SiN
  • Formula Anonymous: ABC3
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm