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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-3972
  • 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: 9
  • Number of elements: 3
  • Element list: ['Pd', 'S', 'Cl']
  • Chemical System: Cl-Pd-S
  • Density: 2.796659584807342
  • Atomic Density: 0.039548540225116224
  • Unit Cell Volume: 227.56845003053587
  • Molar Volume: 15.22721376243237
  • Full Formula: Pd1 S2 Cl6
  • Reduced Formula: Pd(SCl3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1