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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-120557
  • 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: 20
  • Number of elements: 3
  • Element list: ['Ca', 'Cd', 'N']
  • Chemical System: Ca-Cd-N
  • Density: 3.4013140258769314
  • Atomic Density: 0.05553592174958535
  • Unit Cell Volume: 360.12727204170926
  • Molar Volume: 10.843685618749928
  • Full Formula: Ca10 Cd2 N8
  • Reduced Formula: Ca5CdN4
  • Formula Anonymous: AB4C5
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm