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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-24270
  • 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: 28
  • Number of elements: 4
  • Element list: ['Nd', 'Si', 'S', 'Br']
  • Chemical System: Br-Nd-S-Si
  • Density: 4.174020757011332
  • Atomic Density: 0.042639357001213976
  • Unit Cell Volume: 656.6703151551469
  • Molar Volume: 14.1234323956352
  • Full Formula: Nd6 Si4 S16 Br2
  • Reduced Formula: Nd3Si2S8Br
  • Formula Anonymous: AB2C3D8
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m