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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-31711
  • 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', 'Se']
  • Chemical System: Nb-Se-W
  • Density: 7.4961733476315375
  • Atomic Density: 0.04570777790376958
  • Unit Cell Volume: 262.53737438875464
  • Molar Volume: 13.175308527749165
  • Full Formula: Nb2 W2 Se8
  • Reduced Formula: NbWSe4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 51
  • Spacegroup Symbol: Pmma
  • Crystal System: orthorhombic
  • Pointgroup: mmm