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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-25440
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 14
  • Number of elements: 3
  • Element list: ['Nb', 'Te', 'As']
  • Chemical System: As-Nb-Te
  • Density: 7.085573512529729
  • Atomic Density: 0.04055889785615246
  • Unit Cell Volume: 345.1770324147581
  • Molar Volume: 14.847890545148259
  • Full Formula: Nb6 Te6 As2
  • Reduced Formula: Nb3Te3As
  • Formula Anonymous: AB3C3
  • Spacegroup Number: 176
  • Spacegroup Symbol: P6_3/m
  • Crystal System: hexagonal
  • Pointgroup: 6/m