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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116140
  • 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: 3
  • Element list: ['Li', 'H', 'S']
  • Chemical System: H-Li-S
  • Density: 0.4067957930973234
  • Atomic Density: 0.018366960570150127
  • Unit Cell Volume: 163.33676922438553
  • Molar Volume: 32.787900518429524
  • Full Formula: Li1 H1 S1
  • Reduced Formula: LiHS
  • Formula Anonymous: ABC
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm