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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-117337
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 3
  • Element list: ['Nd', 'C', 'O']
  • Chemical System: C-Nd-O
  • Density: 4.973935701506149
  • Atomic Density: 0.08159918311850857
  • Unit Cell Volume: 294.1205914420024
  • Molar Volume: 7.3801483419924585
  • Full Formula: Nd4 C4 O16
  • Reduced Formula: NdCO4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm