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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-39669
  • Created at: Sept. 4, 2022, 3:32 p.m.
  • Last updated at: Sept. 4, 2022, 3:32 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 104
  • Number of elements: 2
  • Element list: ['P', 'S']
  • Chemical System: P-S
  • Density: 1.9587476596822422
  • Atomic Density: 0.03717661117321355
  • Unit Cell Volume: 2797.4577756816616
  • Molar Volume: 16.198735091645645
  • Full Formula: P32 S72
  • Reduced Formula: P4S9
  • Formula Anonymous: A4B9
  • Spacegroup Number: 206
  • Spacegroup Symbol: Ia-3
  • Crystal System: cubic
  • Pointgroup: m-3