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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101445
  • 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: 4
  • Number of elements: 3
  • Element list: ['Y', 'Th', 'N']
  • Chemical System: N-Th-Y
  • Density: 8.928862482993077
  • Atomic Density: 0.06163603991313376
  • Unit Cell Volume: 64.89709601131686
  • Molar Volume: 9.770486177384617
  • Full Formula: Y1 Th1 N2
  • Reduced Formula: YThN2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm