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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107646
  • 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: 8
  • Number of elements: 2
  • Element list: ['Yb', 'Ba']
  • Chemical System: Ba-Yb
  • Density: 4.499537124045853
  • Atomic Density: 0.018527092822455123
  • Unit Cell Volume: 431.80007120727953
  • Molar Volume: 32.50451011235326
  • Full Formula: Ba6 Yb2
  • Reduced Formula: Ba3Yb
  • Formula Anonymous: AB3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm