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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12594
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 4
  • Element list: ['Nd', 'H', 'Cl', 'O']
  • Chemical System: Cl-H-Nd-O
  • Density: 4.657855939212957
  • Atomic Density: 0.07875243867877957
  • Unit Cell Volume: 152.37623369285566
  • Molar Volume: 7.6469260648085955
  • Full Formula: Nd2 H4 Cl2 O4
  • Reduced Formula: NdH2ClO2
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m