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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98072
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 50
  • Number of elements: 4
  • Element list: ['Cu', 'Te', 'Cl', 'O']
  • Chemical System: Cl-Cu-O-Te
  • Density: 4.924023371345365
  • Atomic Density: 0.06046784819326865
  • Unit Cell Volume: 826.8857168554918
  • Molar Volume: 9.959244358674553
  • Full Formula: Cu8 Te10 Cl8 O24
  • Reduced Formula: Cu4Te5(ClO3)4
  • Formula Anonymous: A4B4C5D12
  • Spacegroup Number: 85
  • Spacegroup Symbol: P4/n1
  • Crystal System: tetragonal
  • Pointgroup: 4/m