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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116305
  • 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: ['Li', 'Se']
  • Chemical System: Li-Se
  • Density: 0.16618465217835335
  • Atomic Density: 0.0032338403995461167
  • Unit Cell Volume: 927.6895669993679
  • Molar Volume: 186.22257180178818
  • Full Formula: Li2 Se1
  • Reduced Formula: Li2Se
  • Formula Anonymous: AB2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm