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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-32381
  • 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: 22
  • Number of elements: 3
  • Element list: ['Ta', 'Te', 'Cl']
  • Chemical System: Cl-Ta-Te
  • Density: 3.472334588274986
  • Atomic Density: 0.036649242506126375
  • Unit Cell Volume: 600.2852581829604
  • Molar Volume: 16.43182873150332
  • Full Formula: Ta2 Te2 Cl18
  • Reduced Formula: TaTeCl9
  • Formula Anonymous: ABC9
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1