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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12483
  • 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: 12
  • Number of elements: 3
  • Element list: ['Pb', 'I', 'Cl']
  • Chemical System: Cl-I-Pb
  • Density: 6.6819952940102985
  • Atomic Density: 0.03266602856012652
  • Unit Cell Volume: 367.3541146243804
  • Molar Volume: 18.435484891943275
  • Full Formula: Pb4 I4 Cl4
  • Reduced Formula: PbICl
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm