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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-90534
  • 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: 9
  • Number of elements: 3
  • Element list: ['Li', 'Ti', 'S']
  • Chemical System: Li-S-Ti
  • Density: 1.8677294037954852
  • Atomic Density: 0.0496488635477821
  • Unit Cell Volume: 181.27303138244835
  • Molar Volume: 12.129463455300014
  • Full Formula: Li4 Ti1 S4
  • Reduced Formula: Li4TiS4
  • Formula Anonymous: AB4C4
  • Spacegroup Number: 121
  • Spacegroup Symbol: I-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m