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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103445
  • 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: 6
  • Number of elements: 3
  • Element list: ['Na', 'Te', 'Se']
  • Chemical System: Na-Se-Te
  • Density: 2.845002643388745
  • Atomic Density: 0.03443600298970382
  • Unit Cell Volume: 174.23624924745093
  • Molar Volume: 17.487920307709892
  • Full Formula: Na4 Te1 Se1
  • Reduced Formula: Na4TeSe
  • Formula Anonymous: ABC4
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm