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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22536
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['K', 'Sc', 'F']
  • Chemical System: F-K-Sc
  • Density: 3.068128460111949
  • Atomic Density: 0.0705220449044575
  • Unit Cell Volume: 141.79963178248576
  • Molar Volume: 8.53937342310299
  • Full Formula: K1 Sc2 F7
  • Reduced Formula: KSc2F7
  • Formula Anonymous: AB2C7
  • Spacegroup Number: 65
  • Spacegroup Symbol: Cmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm