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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102467
  • 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: 4
  • Number of elements: 2
  • Element list: ['Cd', 'Se']
  • Chemical System: Cd-Se
  • Density: 6.835854930689153
  • Atomic Density: 0.03956479866002204
  • Unit Cell Volume: 101.0999710720573
  • Molar Volume: 15.22095641569643
  • Full Formula: Cd3 Se1
  • Reduced Formula: Cd3Se
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm