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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-88347
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 55
  • Number of elements: 4
  • Element list: ['P', 'H', 'N', 'O']
  • Chemical System: H-N-O-P
  • Density: 1.9431527478081232
  • Atomic Density: 0.10761538745186144
  • Unit Cell Volume: 511.0793289166256
  • Molar Volume: 5.5959848332041044
  • Full Formula: P6 H24 N6 O19
  • Reduced Formula: P6H24N6O19
  • Formula Anonymous: A6B6C19D24
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3