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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112697
  • 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: 22
  • Number of elements: 4
  • Element list: ['Be', 'B', 'H', 'O']
  • Chemical System: B-Be-H-O
  • Density: 2.0567720258165627
  • Atomic Density: 0.12180629834892187
  • Unit Cell Volume: 180.6146340395273
  • Molar Volume: 4.944030679554186
  • Full Formula: Be4 B2 H6 O10
  • Reduced Formula: Be2BH3O5
  • Formula Anonymous: AB2C3D5
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2