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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-403085
  • Created at: Sept. 4, 2022, 2:57 p.m.
  • Last updated at: Sept. 4, 2022, 2:57 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Ac', 'Al', 'Ca']
  • Chemical System: Ac-Al-Ca
  • Density: 6.146103755310691
  • Atomic Density: 0.0284134147527811
  • Unit Cell Volume: 140.77857359993948
  • Molar Volume: 21.194709655271385
  • Full Formula: Ca1 Ac2 Al1
  • Reduced Formula: CaAc2Al
  • Formula Anonymous: ABC2
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m