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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-115897
  • 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: 6
  • Number of elements: 2
  • Element list: ['P', 'Cl']
  • Chemical System: Cl-P
  • Density: 1.0448864609377722
  • Atomic Density: 0.01813049584349731
  • Unit Cell Volume: 330.93413725648116
  • Molar Volume: 33.215532614128165
  • Full Formula: P1 Cl5
  • Reduced Formula: PCl5
  • Formula Anonymous: AB5
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2