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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-123671
  • 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: 3
  • Number of elements: 2
  • Element list: ['Se', 'I']
  • Chemical System: I-Se
  • Density: 5.253069490823212
  • Atomic Density: 0.03332023113049015
  • Unit Cell Volume: 90.03538985822962
  • Molar Volume: 18.07352637025784
  • Full Formula: Se2 I1
  • Reduced Formula: Se2I
  • Formula Anonymous: AB2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m