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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1724
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['Ni', 'S', 'Sn']
  • Chemical System: Ni-S-Sn
  • Density: 6.810048312846559
  • Atomic Density: 0.06010455091737192
  • Unit Cell Volume: 116.46372684196865
  • Molar Volume: 10.019442235378937
  • Full Formula: Ni3 Sn2 S2
  • Reduced Formula: Ni3(SnS)2
  • Formula Anonymous: A2B2C3
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m