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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104138
  • 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: 50
  • Number of elements: 3
  • Element list: ['H', 'C', 'O']
  • Chemical System: C-H-O
  • Density: 1.4581886564203395
  • Atomic Density: 0.11302940641379838
  • Unit Cell Volume: 442.36275838653
  • Molar Volume: 5.327941595971108
  • Full Formula: H20 C28 O2
  • Reduced Formula: H10C14O
  • Formula Anonymous: AB10C14
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2