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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-70941
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Li', 'Be', 'Fe']
  • Chemical System: Be-Fe-Li
  • Density: 2.653603320568722
  • Atomic Density: 0.0811812991564516
  • Unit Cell Volume: 49.27243147823059
  • Molar Volume: 7.418137948733987
  • Full Formula: Li2 Be1 Fe1
  • Reduced Formula: Li2BeFe
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm