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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-2827
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['Cr', 'Nb', 'Se']
  • Chemical System: Cr-Nb-Se
  • Density: 6.656112365204978
  • Atomic Density: 0.0506798332684098
  • Unit Cell Volume: 138.12200136742166
  • Molar Volume: 11.88271620410751
  • Full Formula: Nb2 Cr1 Se4
  • Reduced Formula: Nb2CrSe4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m