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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1759427
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 20
  • Number of elements: 3
  • Element list: ['C', 'Nd', 'O']
  • Chemical System: C-Nd-O
  • Density: 5.621524332536543
  • Atomic Density: 0.08287261115617897
  • Unit Cell Volume: 241.33425652908008
  • Molar Volume: 7.266744315140348
  • Full Formula: Nd4 C4 O12
  • Reduced Formula: NdCO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m