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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29349
  • 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: 13
  • Number of elements: 2
  • Element list: ['Sc', 'Cl']
  • Chemical System: Cl-Sc
  • Density: 2.7578223528561865
  • Atomic Density: 0.04246703687013487
  • Unit Cell Volume: 306.1197803782328
  • Molar Volume: 14.180741591215416
  • Full Formula: Sc5 Cl8
  • Reduced Formula: Sc5Cl8
  • Formula Anonymous: A5B8
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m