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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12881
  • 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: 18
  • Number of elements: 3
  • Element list: ['Fe', 'Se', 'Cl']
  • Chemical System: Cl-Fe-Se
  • Density: 2.667610490083663
  • Atomic Density: 0.0377523742550949
  • Unit Cell Volume: 476.79120466365885
  • Molar Volume: 15.951687486747346
  • Full Formula: Fe2 Se2 Cl14
  • Reduced Formula: FeSeCl7
  • Formula Anonymous: ABC7
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1