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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107913
  • 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: 4
  • Number of elements: 2
  • Element list: ['Cu', 'Au']
  • Chemical System: Au-Cu
  • Density: 16.376361175849876
  • Atomic Density: 0.06027742324033507
  • Unit Cell Volume: 66.35983731506577
  • Molar Volume: 9.990707028050664
  • Full Formula: Cu1 Au3
  • Reduced Formula: CuAu3
  • Formula Anonymous: AB3
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm