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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-95989
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 65
  • Number of elements: 5
  • Element list: ['B', 'H', 'K', 'Mg', 'O']
  • Chemical System: B-H-K-Mg-O
  • Density: 2.2111690674456903
  • Atomic Density: 0.11818246777053429
  • Unit Cell Volume: 549.9969769306683
  • Molar Volume: 5.095629557924549
  • Full Formula: K2 Mg1 B12 H20 O30
  • Reduced Formula: K2MgB12(H2O3)10
  • Formula Anonymous: AB2C12D20E30
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1