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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-3548
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 56
  • Number of elements: 2
  • Element list: ['P', 'S']
  • Chemical System: P-S
  • Density: 1.918468614763939
  • Atomic Density: 0.03674542172856565
  • Unit Cell Volume: 1523.999381845874
  • Molar Volume: 16.388819277908645
  • Full Formula: P32 S24
  • Reduced Formula: P4S3
  • Formula Anonymous: A3B4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm