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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85366
  • 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: 16
  • Number of elements: 5
  • Element list: ['K', 'Fe', 'Cu', 'C', 'N']
  • Chemical System: C-Cu-Fe-K-N
  • Density: 2.367837024041673
  • Atomic Density: 0.06450560537618591
  • Unit Cell Volume: 248.0404595335657
  • Molar Volume: 9.335841009288854
  • Full Formula: K2 Fe1 Cu1 C6 N6
  • Reduced Formula: K2FeCu(CN)6
  • Formula Anonymous: ABC2D6E6
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m