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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51658
  • 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: 14
  • Number of elements: 3
  • Element list: ['Ni', 'Bi', 'S']
  • Chemical System: Bi-Ni-S
  • Density: 8.366874921636457
  • Atomic Density: 0.053588731441790736
  • Unit Cell Volume: 261.2489533402579
  • Molar Volume: 11.237699788697896
  • Full Formula: Ni6 Bi4 S4
  • Reduced Formula: Ni3(BiS)2
  • Formula Anonymous: A2B2C3
  • Spacegroup Number: 199
  • Spacegroup Symbol: I2_13
  • Crystal System: cubic
  • Pointgroup: 23