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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98779
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['Bi', 'S', 'N', 'Cl']
  • Chemical System: Bi-Cl-N-S
  • Density: 3.02126049847103
  • Atomic Density: 0.04190078578479868
  • Unit Cell Volume: 572.7816209286232
  • Molar Volume: 14.372381441554712
  • Full Formula: Bi2 S8 N6 Cl8
  • Reduced Formula: BiS4N3Cl4
  • Formula Anonymous: AB3C4D4
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1