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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-39095
  • 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: 60
  • Number of elements: 4
  • Element list: ['Cl', 'O', 'P', 'Sn']
  • Chemical System: Cl-O-P-Sn
  • Density: 2.196546002671994
  • Atomic Density: 0.034982972945793465
  • Unit Cell Volume: 1715.1200983681608
  • Molar Volume: 17.21449108779685
  • Full Formula: Sn4 P8 Cl40 O8
  • Reduced Formula: SnP2(Cl5O)2
  • Formula Anonymous: AB2C2D10
  • Spacegroup Number: 58
  • Spacegroup Symbol: Pnnm
  • Crystal System: orthorhombic
  • Pointgroup: mmm