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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1322058
  • Created at: Sept. 4, 2022, 3:45 p.m.
  • Last updated at: Sept. 4, 2022, 3:45 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 56
  • Number of elements: 3
  • Element list: ['Ca', 'S', 'Sn']
  • Chemical System: Ca-S-Sn
  • Density: 3.7248740468544894
  • Atomic Density: 0.03869843867977057
  • Unit Cell Volume: 1447.086805320488
  • Molar Volume: 15.561715059961955
  • Full Formula: Ca8 Sn16 S32
  • Reduced Formula: Ca(SnS2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 43
  • Spacegroup Symbol: Fdd2
  • Crystal System: orthorhombic
  • Pointgroup: mm2