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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-95245
  • 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: 64
  • Number of elements: 4
  • Element list: ['P', 'H', 'N', 'O']
  • Chemical System: H-N-O-P
  • Density: 1.6321799266571664
  • Atomic Density: 0.11909130361003603
  • Unit Cell Volume: 537.4027998683072
  • Molar Volume: 5.056742665039148
  • Full Formula: P4 H36 N8 O16
  • Reduced Formula: PH9(NO2)2
  • Formula Anonymous: AB2C4D9
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m