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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-4110
  • 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: 7
  • Number of elements: 3
  • Element list: ['Tl', 'Pd', 'Cl']
  • Chemical System: Cl-Pd-Tl
  • Density: 5.129219208581707
  • Atomic Density: 0.03291059684382062
  • Unit Cell Volume: 212.69744918996625
  • Molar Volume: 18.298485404498923
  • Full Formula: Tl2 Pd1 Cl4
  • Reduced Formula: Tl2PdCl4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm