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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-32248
  • 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: 22
  • Number of elements: 3
  • Element list: ['Al', 'Pd', 'Cl']
  • Chemical System: Al-Cl-Pd
  • Density: 2.4870191916948574
  • Atomic Density: 0.03710503381909159
  • Unit Cell Volume: 592.9114660631404
  • Molar Volume: 16.229983212955432
  • Full Formula: Al4 Pd2 Cl16
  • Reduced Formula: Al2PdCl8
  • Formula Anonymous: AB2C8
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m