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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-19751
  • 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: 6
  • Number of elements: 2
  • Element list: ['Ni', 'S']
  • Chemical System: Ni-S
  • Density: 5.398511922953596
  • Atomic Density: 0.0716420710497316
  • Unit Cell Volume: 83.74967267256966
  • Molar Volume: 8.405871957302331
  • Full Formula: Ni3 S3
  • Reduced Formula: NiS
  • Formula Anonymous: AB
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m