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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-74403
  • 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: 4
  • Number of elements: 3
  • Element list: ['Be', 'Cd', 'Cl']
  • Chemical System: Be-Cd-Cl
  • Density: 3.7872960247964222
  • Atomic Density: 0.05499512857693705
  • Unit Cell Volume: 72.73371484901763
  • Molar Volume: 10.950316720462158
  • Full Formula: Be2 Cd1 Cl1
  • Reduced Formula: Be2CdCl
  • Formula Anonymous: ABC2
  • Spacegroup Number: 119
  • Spacegroup Symbol: I-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2