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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-50077
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 9
  • Number of elements: 4
  • Element list: ['Li', 'Cu', 'S', 'O']
  • Chemical System: Cu-Li-O-S
  • Density: 2.4080224610037746
  • Atomic Density: 0.08040736394078643
  • Unit Cell Volume: 111.93004668860651
  • Molar Volume: 7.489538849246226
  • Full Formula: Li5 Cu1 S1 O2
  • Reduced Formula: Li5CuSO2
  • Formula Anonymous: ABC2D5
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm