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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116648
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 20
  • Number of elements: 4
  • Element list: ['Sr', 'Ca', 'Mn', 'O']
  • Chemical System: Ca-Mn-O-Sr
  • Density: 5.08462473381012
  • Atomic Density: 0.09179566774436133
  • Unit Cell Volume: 217.87520578528094
  • Molar Volume: 6.5603757867646415
  • Full Formula: Sr2 Ca2 Mn4 O12
  • Reduced Formula: SrCaMn2O6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 26
  • Spacegroup Symbol: Pmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2