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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100346
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 7
  • Number of elements: 4
  • Element list: ['Sr', 'Cu', 'O', 'F']
  • Chemical System: Cu-F-O-Sr
  • Density: 4.805715834822656
  • Atomic Density: 0.06560782000616264
  • Unit Cell Volume: 106.69459828633964
  • Molar Volume: 9.178998417314174
  • Full Formula: Sr2 Cu1 O2 F2
  • Reduced Formula: Sr2Cu(OF)2
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2