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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35258
  • 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: 4
  • Element list: ['K', 'Cu', 'Cl', 'F']
  • Chemical System: Cl-Cu-F-K
  • Density: 2.9828426529650813
  • Atomic Density: 0.050167162485474745
  • Unit Cell Volume: 279.06700930222075
  • Molar Volume: 12.00414865350145
  • Full Formula: K4 Cu2 Cl4 F4
  • Reduced Formula: K2Cu(ClF)2
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm