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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-40519
  • 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: 4
  • Number of elements: 3
  • Element list: ['Sc', 'Nb', 'Tc']
  • Chemical System: Nb-Sc-Tc
  • Density: 8.421573245958658
  • Atomic Density: 0.06076265662890671
  • Unit Cell Volume: 65.82990642474763
  • Molar Volume: 9.910924067686466
  • Full Formula: Sc1 Nb1 Tc2
  • Reduced Formula: ScNbTc2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m