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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116129
  • 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: 6
  • Number of elements: 3
  • Element list: ['Li', 'H', 'O']
  • Chemical System: H-Li-O
  • Density: 1.5261602378363182
  • Atomic Density: 0.11513221932386353
  • Unit Cell Volume: 52.11399584960816
  • Molar Volume: 5.230630309539936
  • Full Formula: Li2 H2 O2
  • Reduced Formula: LiHO
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm