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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12936
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Na', 'Li', 'Se']
  • Chemical System: Li-Na-Se
  • Density: 3.099491066700475
  • Atomic Density: 0.05142466607014286
  • Unit Cell Volume: 233.3510534347873
  • Molar Volume: 11.710607418988088
  • Full Formula: Na4 Li4 Se4
  • Reduced Formula: NaLiSe
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm