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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-11590
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 15
  • Number of elements: 5
  • Element list: ['Sr', 'Ca', 'Fe', 'S', 'O']
  • Chemical System: Ca-Fe-O-S-Sr
  • Density: 4.330692040049528
  • Atomic Density: 0.0590603374671542
  • Unit Cell Volume: 253.97755318181336
  • Molar Volume: 10.196590500941774
  • Full Formula: Sr4 Ca1 Fe2 S2 O6
  • Reduced Formula: Sr4CaFe2(SO3)2
  • Formula Anonymous: AB2C2D4E6
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2