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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98599
  • 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: 28
  • Number of elements: 4
  • Element list: ['P', 'H', 'I', 'N']
  • Chemical System: H-I-N-P
  • Density: 2.2087722508917143
  • Atomic Density: 0.08389545366204908
  • Unit Cell Volume: 333.7487167396542
  • Molar Volume: 7.1781491095555925
  • Full Formula: P2 H16 I2 N8
  • Reduced Formula: PH8IN4
  • Formula Anonymous: ABC4D8
  • Spacegroup Number: 125
  • Spacegroup Symbol: P4/nbm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm