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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-95313
  • 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: 34
  • Number of elements: 3
  • Element list: ['Nb', 'P', 'O']
  • Chemical System: Nb-O-P
  • Density: 3.106340407967007
  • Atomic Density: 0.0675584851302921
  • Unit Cell Volume: 503.2676492734881
  • Molar Volume: 8.913966540821345
  • Full Formula: Nb4 P6 O24
  • Reduced Formula: Nb2(PO4)3
  • Formula Anonymous: A2B3C12
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m