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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-3438
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Li', 'In', 'Se']
  • Chemical System: In-Li-Se
  • Density: 4.4086915972246965
  • Atomic Density: 0.037971762449224115
  • Unit Cell Volume: 210.6828728505191
  • Molar Volume: 15.859523950337604
  • Full Formula: Li2 In2 Se4
  • Reduced Formula: LiInSe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 122
  • Spacegroup Symbol: I-42d
  • Crystal System: tetragonal
  • Pointgroup: -42m