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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-45900
  • 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: 11
  • Number of elements: 4
  • Element list: ['Li', 'Fe', 'C', 'O']
  • Chemical System: C-Fe-Li-O
  • Density: 2.6622488573480902
  • Atomic Density: 0.09294421295816176
  • Unit Cell Volume: 118.35056374033292
  • Molar Volume: 6.479306853360336
  • Full Formula: Li2 Fe1 C2 O6
  • Reduced Formula: Li2Fe(CO3)2
  • Formula Anonymous: AB2C2D6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m