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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112214
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 43
  • Number of elements: 3
  • Element list: ['H', 'C', 'O']
  • Chemical System: C-H-O
  • Density: 1.4095758056792342
  • Atomic Density: 0.1168564793777312
  • Unit Cell Volume: 367.97274938435555
  • Molar Volume: 5.153450447992541
  • Full Formula: H20 C19 O4
  • Reduced Formula: H20C19O4
  • Formula Anonymous: A4B19C20
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1