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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-68745
  • 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: 4
  • Number of elements: 3
  • Element list: ['Be', 'Nb', 'Mo']
  • Chemical System: Be-Mo-Nb
  • Density: 6.269522661730011
  • Atomic Density: 0.07300393907800833
  • Unit Cell Volume: 54.791563996646836
  • Molar Volume: 8.249062771208886
  • Full Formula: Be2 Nb1 Mo1
  • Reduced Formula: Be2NbMo
  • Formula Anonymous: ABC2
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm