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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102230
  • 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: 8
  • Number of elements: 3
  • Element list: ['Al', 'Ni', 'Pd']
  • Chemical System: Al-Ni-Pd
  • Density: 8.613554549765375
  • Atomic Density: 0.08546310381758801
  • Unit Cell Volume: 93.60764637187945
  • Molar Volume: 7.046480283297017
  • Full Formula: Al1 Ni6 Pd1
  • Reduced Formula: AlNi6Pd
  • Formula Anonymous: ABC6
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm