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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29304
  • 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: 40
  • Number of elements: 3
  • Element list: ['Nb', 'Si', 'Te']
  • Chemical System: Nb-Si-Te
  • Density: 6.659027879639097
  • Atomic Density: 0.037394097091755625
  • Unit Cell Volume: 1069.6875472577972
  • Molar Volume: 16.104522447014016
  • Full Formula: Nb12 Si4 Te24
  • Reduced Formula: Nb3SiTe6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm