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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21631
  • 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: 10
  • Number of elements: 3
  • Element list: ['Pr', 'B', 'C']
  • Chemical System: B-C-Pr
  • Density: 5.458079877211966
  • Atomic Density: 0.08809740098287551
  • Unit Cell Volume: 113.51072663248958
  • Molar Volume: 6.83577573550733
  • Full Formula: Pr2 B4 C4
  • Reduced Formula: Pr(BC)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm