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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-90031
  • 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: 9
  • Number of elements: 3
  • Element list: ['Ba', 'Cd', 'As']
  • Chemical System: As-Ba-Cd
  • Density: 5.711625591539656
  • Atomic Density: 0.03305599824546974
  • Unit Cell Volume: 272.2652613049867
  • Molar Volume: 18.21799697374235
  • Full Formula: Ba3 Cd2 As4
  • Reduced Formula: Ba3(CdAs2)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m