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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-68782
  • 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: 5
  • Number of elements: 3
  • Element list: ['Be', 'Ga', 'Fe']
  • Chemical System: Be-Fe-Ga
  • Density: 5.8247608879107675
  • Atomic Density: 0.08794121941078017
  • Unit Cell Volume: 56.856159529066986
  • Molar Volume: 6.847915915141134
  • Full Formula: Be2 Ga1 Fe2
  • Reduced Formula: Be2GaFe2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm