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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85984
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 4
  • Element list: ['Sr', 'Cu', 'Cl', 'O']
  • Chemical System: Cl-Cu-O-Sr
  • Density: 3.9511381540610433
  • Atomic Density: 0.04661928109629504
  • Unit Cell Volume: 386.10634005316115
  • Molar Volume: 12.91770404515868
  • Full Formula: Sr6 Cu3 Cl3 O6
  • Reduced Formula: Sr2CuClO2
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m