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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-94314
  • 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: 6
  • Number of elements: 2
  • Element list: ['C', 'O']
  • Chemical System: C-O
  • Density: 1.7368109414815847
  • Atomic Density: 0.07129815130863615
  • Unit Cell Volume: 84.1536546161925
  • Molar Volume: 8.446419226118918
  • Full Formula: C2 O4
  • Reduced Formula: CO2
  • Formula Anonymous: AB2
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm