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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98842
  • 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: 54
  • Number of elements: 5
  • Element list: ['K', 'Cu', 'H', 'C', 'O']
  • Chemical System: C-Cu-H-K-O
  • Density: 2.25349566508218
  • Atomic Density: 0.0939903093877027
  • Unit Cell Volume: 574.5273140580292
  • Molar Volume: 6.407193251337368
  • Full Formula: K4 Cu2 H16 C8 O24
  • Reduced Formula: K2CuH8(CO3)4
  • Formula Anonymous: AB2C4D8E12
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m