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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14109
  • 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: 24
  • Number of elements: 2
  • Element list: ['P', 'Cl']
  • Chemical System: Cl-P
  • Density: 2.245248391556522
  • Atomic Density: 0.03895874638302818
  • Unit Cell Volume: 616.0362493197485
  • Molar Volume: 15.457737527774919
  • Full Formula: P4 Cl20
  • Reduced Formula: PCl5
  • Formula Anonymous: AB5
  • Spacegroup Number: 85
  • Spacegroup Symbol: P4/n1
  • Crystal System: tetragonal
  • Pointgroup: 4/m