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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-999609
  • Created at: Sept. 4, 2022, 3:26 p.m.
  • Last updated at: Sept. 4, 2022, 3:26 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 4
  • Element list: ['Ca', 'Cu', 'Ni', 'Ta']
  • Chemical System: Ca-Cu-Ni-Ta
  • Density: 8.98276585184764
  • Atomic Density: 0.06303635531404986
  • Unit Cell Volume: 63.45544535485636
  • Molar Volume: 9.55344059788583
  • Full Formula: Ca1 Ta1 Cu1 Ni1
  • Reduced Formula: CaTaCuNi
  • Formula Anonymous: ABCD
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m