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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117884
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['C', 'S', 'Cl']
  • Chemical System: C-Cl-S
  • Density: 1.39744237493415
  • Atomic Density: 0.03174550076419103
  • Unit Cell Volume: 94.50158062663179
  • Molar Volume: 18.970060685868855
  • Full Formula: C1 S1 Cl1
  • Reduced Formula: CSCl
  • Formula Anonymous: ABC
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm