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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103426
  • 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: 6
  • Number of elements: 3
  • Element list: ['Sc', 'Ta', 'N']
  • Chemical System: N-Sc-Ta
  • Density: 9.401484931077762
  • Atomic Density: 0.07079773605007841
  • Unit Cell Volume: 84.74847268782622
  • Molar Volume: 8.506120528685084
  • Full Formula: Sc2 Ta2 N2
  • Reduced Formula: ScTaN
  • Formula Anonymous: ABC
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1