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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104673
  • 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: 10
  • Number of elements: 4
  • Element list: ['Tl', 'Ga', 'Cu', 'Se']
  • Chemical System: Cu-Ga-Se-Tl
  • Density: 7.34669022824204
  • Atomic Density: 0.044918028460915325
  • Unit Cell Volume: 222.62775866713147
  • Molar Volume: 13.40695699776776
  • Full Formula: Tl2 Ga1 Cu3 Se4
  • Reduced Formula: Tl2GaCu3Se4
  • Formula Anonymous: AB2C3D4
  • Spacegroup Number: 21
  • Spacegroup Symbol: C222
  • Crystal System: orthorhombic
  • Pointgroup: 222