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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-65120
  • 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: 6
  • Number of elements: 3
  • Element list: ['Sc', 'Ti', 'Be']
  • Chemical System: Be-Sc-Ti
  • Density: 3.114409081392096
  • Atomic Density: 0.04754166195354817
  • Unit Cell Volume: 126.20509577184023
  • Molar Volume: 12.667080856121713
  • Full Formula: Sc4 Ti1 Be1
  • Reduced Formula: Sc4TiBe
  • Formula Anonymous: ABC4
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m