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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-99343
  • 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: 68
  • Number of elements: 5
  • Element list: ['Na', 'Y', 'H', 'C', 'O']
  • Chemical System: C-H-Na-O-Y
  • Density: 2.306663929782445
  • Atomic Density: 0.1058974683961114
  • Unit Cell Volume: 642.1305535430249
  • Molar Volume: 5.686765558430608
  • Full Formula: Na6 Y2 H24 C6 O30
  • Reduced Formula: Na3YH12(CO5)3
  • Formula Anonymous: AB3C3D12E15
  • Spacegroup Number: 173
  • Spacegroup Symbol: P6_3
  • Crystal System: hexagonal
  • Pointgroup: 6