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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119154
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 19
  • Number of elements: 3
  • Element list: ['Nd', 'Ti', 'Fe']
  • Chemical System: Fe-Nd-Ti
  • Density: 8.039609967986678
  • Atomic Density: 0.07479626685152177
  • Unit Cell Volume: 254.02337308781657
  • Molar Volume: 8.051392152972774
  • Full Formula: Nd2 Ti1 Fe16
  • Reduced Formula: Nd2TiFe16
  • Formula Anonymous: AB2C16
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m