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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-96082
  • 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: 22
  • Number of elements: 3
  • Element list: ['Sn', 'S', 'I']
  • Chemical System: I-S-Sn
  • Density: 5.228096283148787
  • Atomic Density: 0.027305760497531816
  • Unit Cell Volume: 805.6907992725049
  • Molar Volume: 22.05447001025423
  • Full Formula: Sn8 S2 I12
  • Reduced Formula: Sn4SI6
  • Formula Anonymous: AB4C6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m