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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85754
  • 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: 18
  • Number of elements: 3
  • Element list: ['Al', 'Se', 'Cl']
  • Chemical System: Al-Cl-Se
  • Density: 2.379265597957339
  • Atomic Density: 0.03641623411057772
  • Unit Cell Volume: 494.285047304537
  • Molar Volume: 16.536967391284335
  • Full Formula: Al2 Se2 Cl14
  • Reduced Formula: AlSeCl7
  • Formula Anonymous: ABC7
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1