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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109376
  • 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: 9
  • Number of elements: 3
  • Element list: ['Nb', 'N', 'O']
  • Chemical System: N-Nb-O
  • Density: 7.976932799272825
  • Atomic Density: 0.0824227952429443
  • Unit Cell Volume: 109.19309365172779
  • Molar Volume: 7.306401999895191
  • Full Formula: Nb5 N2 O2
  • Reduced Formula: Nb5(NO)2
  • Formula Anonymous: A2B2C5
  • Spacegroup Number: 8
  • Spacegroup Symbol: C1m1
  • Crystal System: monoclinic
  • Pointgroup: m