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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-20512
  • 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: 2
  • Number of elements: 2
  • Element list: ['Zr', 'S']
  • Chemical System: S-Zr
  • Density: 5.680023649970759
  • Atomic Density: 0.05548897622995354
  • Unit Cell Volume: 36.04319516928443
  • Molar Volume: 10.852859737479143
  • Full Formula: Zr1 S1
  • Reduced Formula: ZrS
  • Formula Anonymous: AB
  • Spacegroup Number: 225
  • Spacegroup Symbol: Fm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m