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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22430
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Nd', 'B', 'Ir']
  • Chemical System: B-Ir-Nd
  • Density: 13.341871636533119
  • Atomic Density: 0.07561213329200073
  • Unit Cell Volume: 238.05703154131592
  • Molar Volume: 7.964516404719802
  • Full Formula: Nd2 B8 Ir8
  • Reduced Formula: Nd(BIr)4
  • Formula Anonymous: AB4C4
  • Spacegroup Number: 86
  • Spacegroup Symbol: P4_2/n
  • Crystal System: tetragonal
  • Pointgroup: 4/m