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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23504
  • 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: 2
  • Element list: ['Ni', 'Se']
  • Chemical System: Ni-Se
  • Density: 6.778605323024164
  • Atomic Density: 0.056536274430636184
  • Unit Cell Volume: 212.25310866075347
  • Molar Volume: 10.651817475855271
  • Full Formula: Ni4 Se8
  • Reduced Formula: NiSe2
  • Formula Anonymous: AB2
  • Spacegroup Number: 205
  • Spacegroup Symbol: Pa-3
  • Crystal System: cubic
  • Pointgroup: m-3