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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-76204
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Nd', 'Sc', 'Si']
  • Chemical System: Nd-Sc-Si
  • Density: 4.95312699450851
  • Atomic Density: 0.04118367025651374
  • Unit Cell Volume: 145.68881215852832
  • Molar Volume: 14.62264223293095
  • Full Formula: Nd2 Sc2 Si2
  • Reduced Formula: NdScSi
  • Formula Anonymous: ABC
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm