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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-56909
  • 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: 5
  • Number of elements: 3
  • Element list: ['Sm', 'Ni', 'As']
  • Chemical System: As-Ni-Sm
  • Density: 8.302984823531276
  • Atomic Density: 0.05986942138548412
  • Unit Cell Volume: 83.51508807486645
  • Molar Volume: 10.058792319412865
  • Full Formula: Sm1 Ni2 As2
  • Reduced Formula: Sm(NiAs)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm