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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-13988
  • 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: 3
  • Number of elements: 2
  • Element list: ['Al', 'Cu']
  • Chemical System: Al-Cu
  • Density: 3.9502548265329613
  • Atomic Density: 0.06073315656538534
  • Unit Cell Volume: 49.39641160870996
  • Molar Volume: 9.915738124884982
  • Full Formula: Al2 Cu1
  • Reduced Formula: Al2Cu
  • Formula Anonymous: AB2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm