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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-65198
  • 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: 6
  • Number of elements: 3
  • Element list: ['Zr', 'Ta', 'Be']
  • Chemical System: Be-Ta-Zr
  • Density: 11.81240852641646
  • Atomic Density: 0.0517963073663418
  • Unit Cell Volume: 115.83837352658293
  • Molar Volume: 11.626583179775666
  • Full Formula: Zr1 Ta4 Be1
  • Reduced Formula: ZrTa4Be
  • Formula Anonymous: ABC4
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m