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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97008
  • 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: 48
  • Number of elements: 2
  • Element list: ['Nb', 'O']
  • Chemical System: Nb-O
  • Density: 4.039318933220926
  • Atomic Density: 0.058425152260608675
  • Unit Cell Volume: 821.5639693311076
  • Molar Volume: 10.30744555553386
  • Full Formula: Nb16 O32
  • Reduced Formula: NbO2
  • Formula Anonymous: AB2
  • Spacegroup Number: 88
  • Spacegroup Symbol: I4_1/a
  • Crystal System: tetragonal
  • Pointgroup: 4/m