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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52333
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Li', 'Cu', 'S']
  • Chemical System: Cu-Li-S
  • Density: 3.327057605076295
  • Atomic Density: 0.058612243217066345
  • Unit Cell Volume: 204.73538191600753
  • Molar Volume: 10.2745440704213
  • Full Formula: Li4 Cu4 S4
  • Reduced Formula: LiCuS
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm