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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-54723
  • 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: 14
  • Number of elements: 3
  • Element list: ['Y', 'H', 'O']
  • Chemical System: H-O-Y
  • Density: 3.830076096708162
  • Atomic Density: 0.11538573529848735
  • Unit Cell Volume: 121.33215569310961
  • Molar Volume: 5.219138002129582
  • Full Formula: Y2 H6 O6
  • Reduced Formula: Y(HO)3
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 176
  • Spacegroup Symbol: P6_3/m
  • Crystal System: hexagonal
  • Pointgroup: 6/m