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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107645
  • 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: 2
  • Element list: ['Ba', 'La']
  • Chemical System: Ba-La
  • Density: 4.486930873378014
  • Atomic Density: 0.01961996221051499
  • Unit Cell Volume: 203.873991044502
  • Molar Volume: 30.693946784324257
  • Full Formula: Ba3 La1
  • Reduced Formula: Ba3La
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m