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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103762
  • 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: 44
  • Number of elements: 3
  • Element list: ['H', 'C', 'O']
  • Chemical System: C-H-O
  • Density: 1.501112136010515
  • Atomic Density: 0.10797394614664564
  • Unit Cell Volume: 407.5057138343454
  • Molar Volume: 5.577401748215244
  • Full Formula: H16 C24 O4
  • Reduced Formula: H4C6O
  • Formula Anonymous: AB4C6
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm