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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14999
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 2
  • Element list: ['Nb', 'S']
  • Chemical System: Nb-S
  • Density: 2.3854363936841616
  • Atomic Density: 0.02744351418777709
  • Unit Cell Volume: 109.3154462461718
  • Molar Volume: 21.943766817888676
  • Full Formula: Nb1 S2
  • Reduced Formula: NbS2
  • Formula Anonymous: AB2
  • Spacegroup Number: 42
  • Spacegroup Symbol: Fmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2