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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-64852
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ba', 'Na', 'Ta']
  • Chemical System: Ba-Na-Ta
  • Density: 5.3051896836723005
  • Atomic Density: 0.026702178437654846
  • Unit Cell Volume: 149.8005119447215
  • Molar Volume: 22.55299422127936
  • Full Formula: Ba2 Na1 Ta1
  • Reduced Formula: Ba2NaTa
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m