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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-118818
  • 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: 3
  • Number of elements: 3
  • Element list: ['Y', 'Nb', 'O']
  • Chemical System: Nb-O-Y
  • Density: 5.015840919976119
  • Atomic Density: 0.04581040062250536
  • Unit Cell Volume: 65.48731203468638
  • Molar Volume: 13.14579370223078
  • Full Formula: Y1 Nb1 O1
  • Reduced Formula: YNbO
  • Formula Anonymous: ABC
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm