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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-110938
  • 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: 5
  • Number of elements: 3
  • Element list: ['Y', 'P', 'Pd']
  • Chemical System: P-Pd-Y
  • Density: 7.195352749841253
  • Atomic Density: 0.059571372741549465
  • Unit Cell Volume: 83.9329323783172
  • Molar Volume: 10.109118663635757
  • Full Formula: Y1 P2 Pd2
  • Reduced Formula: Y(PPd)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm