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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-26735
  • 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: 18
  • Number of elements: 3
  • Element list: ['Al', 'S', 'Cl']
  • Chemical System: Al-Cl-S
  • Density: 2.077905479127682
  • Atomic Density: 0.03665837376462161
  • Unit Cell Volume: 491.02014496266344
  • Molar Volume: 16.42773571644869
  • Full Formula: Al2 S2 Cl14
  • Reduced Formula: AlSCl7
  • Formula Anonymous: ABC7
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m