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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101994
  • 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: 52
  • Number of elements: 3
  • Element list: ['H', 'C', 'O']
  • Chemical System: C-H-O
  • Density: 1.6218525228254967
  • Atomic Density: 0.12437359772966892
  • Unit Cell Volume: 418.09516609002594
  • Molar Volume: 4.841976810134067
  • Full Formula: H24 C16 O12
  • Reduced Formula: H6C4O3
  • Formula Anonymous: A3B4C6
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m