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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52444
  • 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: 29
  • Number of elements: 5
  • Element list: ['Cr', 'Cd', 'H', 'N', 'O']
  • Chemical System: Cd-Cr-H-N-O
  • Density: 2.497104022480177
  • Atomic Density: 0.10520173567093218
  • Unit Cell Volume: 275.66085117370227
  • Molar Volume: 5.724373957894643
  • Full Formula: Cr2 Cd1 H14 N4 O8
  • Reduced Formula: Cr2CdH14(NO2)4
  • Formula Anonymous: AB2C4D8E14
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m