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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111389
  • 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: 7
  • Number of elements: 3
  • Element list: ['Cr', 'Cu', 'S']
  • Chemical System: Cr-Cu-S
  • Density: 4.5979453703025595
  • Atomic Density: 0.06552653790802264
  • Unit Cell Volume: 106.82694711912998
  • Molar Volume: 9.19038446446396
  • Full Formula: Cr2 Cu1 S4
  • Reduced Formula: Cr2CuS4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m