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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-121990
  • 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: 20
  • Number of elements: 3
  • Element list: ['Nb', 'V', 'Se']
  • Chemical System: Nb-Se-V
  • Density: 6.629251861553122
  • Atomic Density: 0.04969039363683913
  • Unit Cell Volume: 402.49228344153295
  • Molar Volume: 12.119325928493643
  • Full Formula: Nb6 V2 Se12
  • Reduced Formula: Nb3VSe6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 182
  • Spacegroup Symbol: P6_322
  • Crystal System: hexagonal
  • Pointgroup: 622