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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97443
  • 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: 39
  • Number of elements: 4
  • Element list: ['K', 'Al', 'B', 'O']
  • Chemical System: Al-B-K-O
  • Density: 2.4588795906176077
  • Atomic Density: 0.07242914229611001
  • Unit Cell Volume: 538.4572944486545
  • Molar Volume: 8.31452723184247
  • Full Formula: K6 Al6 B6 O21
  • Reduced Formula: K2Al2B2O7
  • Formula Anonymous: A2B2C2D7
  • Spacegroup Number: 150
  • Spacegroup Symbol: P321
  • Crystal System: trigonal
  • Pointgroup: 321