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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85210
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 17
  • Number of elements: 2
  • Element list: ['Ba', 'Al']
  • Chemical System: Al-Ba
  • Density: 3.8987032741620165
  • Atomic Density: 0.03242090459192253
  • Unit Cell Volume: 524.3530436296169
  • Molar Volume: 18.574869627482197
  • Full Formula: Ba7 Al10
  • Reduced Formula: Ba7Al10
  • Formula Anonymous: A7B10
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m