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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-26755
  • 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: 14
  • Number of elements: 5
  • Element list: ['K', 'Cu', 'C', 'O', 'F']
  • Chemical System: C-Cu-F-K-O
  • Density: 3.2779632366050984
  • Atomic Density: 0.0760700647459744
  • Unit Cell Volume: 184.0408582107967
  • Molar Volume: 7.916571098118712
  • Full Formula: K2 Cu2 C2 O6 F2
  • Reduced Formula: KCuCO3F
  • Formula Anonymous: ABCDE3
  • Spacegroup Number: 26
  • Spacegroup Symbol: Pmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2