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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97949
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 84
  • Number of elements: 3
  • Element list: ['Sr', 'B', 'O']
  • Chemical System: B-O-Sr
  • Density: 4.339674480700644
  • Atomic Density: 0.10559878578034934
  • Unit Cell Volume: 795.4636919284671
  • Molar Volume: 5.702850383645838
  • Full Formula: Sr12 B24 O48
  • Reduced Formula: Sr(BO2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3