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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-40360
  • 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: 7
  • Number of elements: 5
  • Element list: ['Rb', 'Sr', 'C', 'O', 'F']
  • Chemical System: C-F-O-Rb-Sr
  • Density: 3.56584313153666
  • Atomic Density: 0.059627522711554776
  • Unit Cell Volume: 117.39545232932379
  • Molar Volume: 10.099599121586538
  • Full Formula: Rb1 Sr1 C1 O3 F1
  • Reduced Formula: RbSrCO3F
  • Formula Anonymous: ABCDE3
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2