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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1714921
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['Ni', 'O', 'Pb', 'S']
  • Chemical System: Ni-O-Pb-S
  • Density: 8.991294104979863
  • Atomic Density: 0.0900713738515586
  • Unit Cell Volume: 111.02306506926851
  • Molar Volume: 6.685965254537741
  • Full Formula: Ni1 Pb2 S1 O6
  • Reduced Formula: NiPb2SO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3