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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112353
  • 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: 12
  • Number of elements: 3
  • Element list: ['Nb', 'W', 'S']
  • Chemical System: Nb-S-W
  • Density: 6.649999737885495
  • Atomic Density: 0.05334022362931169
  • Unit Cell Volume: 224.9709353187961
  • Molar Volume: 11.290055328322048
  • Full Formula: Nb1 W3 S8
  • Reduced Formula: NbW3S8
  • Formula Anonymous: AB3C8
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2