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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-58362
  • 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: 20
  • Number of elements: 4
  • Element list: ['Nd', 'Al', 'B', 'O']
  • Chemical System: Al-B-Nd-O
  • Density: 4.07733646067368
  • Atomic Density: 0.10665962354620344
  • Unit Cell Volume: 187.51238130271744
  • Molar Volume: 5.646129772238784
  • Full Formula: Nd1 Al3 B4 O12
  • Reduced Formula: NdAl3(BO3)4
  • Formula Anonymous: AB3C4D12
  • Spacegroup Number: 155
  • Spacegroup Symbol: R32H
  • Crystal System: trigonal
  • Pointgroup: 32