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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101069
  • 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: ['Al', 'Cu', 'Mo']
  • Chemical System: Al-Cu-Mo
  • Density: 6.1633882401311215
  • Atomic Density: 0.06955624646462527
  • Unit Cell Volume: 57.50741598792726
  • Molar Volume: 8.657943845579311
  • Full Formula: Al2 Cu1 Mo1
  • Reduced Formula: Al2CuMo
  • Formula Anonymous: ABC2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm