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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-362
  • 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: 8
  • Number of elements: 2
  • Element list: ['Zr', 'Se']
  • Chemical System: Se-Zr
  • Density: 5.583927448579644
  • Atomic Density: 0.04099577829053607
  • Unit Cell Volume: 195.14204470773058
  • Molar Volume: 14.689660767802083
  • Full Formula: Zr2 Se6
  • Reduced Formula: ZrSe3
  • Formula Anonymous: AB3
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m