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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-40891
  • Created at: Sept. 4, 2022, 3:19 p.m.
  • Last updated at: Sept. 4, 2022, 3:19 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 39
  • Number of elements: 2
  • Element list: ['Cd', 'I']
  • Chemical System: Cd-I
  • Density: 5.501800849744744
  • Atomic Density: 0.027141574400973676
  • Unit Cell Volume: 1436.910012066246
  • Molar Volume: 22.187882954144186
  • Full Formula: Cd13 I26
  • Reduced Formula: CdI2
  • Formula Anonymous: AB2
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1