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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12913
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Sb', 'I', 'F']
  • Chemical System: F-I-Sb
  • Density: 4.538783521874178
  • Atomic Density: 0.05024901162507802
  • Unit Cell Volume: 358.2160010290959
  • Molar Volume: 11.98459544823067
  • Full Formula: Sb2 I4 F12
  • Reduced Formula: Sb(IF3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1