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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-89930
  • 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', 'Zn', 'As']
  • Chemical System: As-Ba-Zn
  • Density: 5.451657494968196
  • Atomic Density: 0.03507192402291807
  • Unit Cell Volume: 256.6155194143004
  • Molar Volume: 17.17083087903811
  • Full Formula: Ba3 Zn2 As4
  • Reduced Formula: Ba3(ZnAs2)2
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m