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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21158
  • 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: 31
  • Number of elements: 4
  • Element list: ['Ba', 'Ta', 'Te', 'O']
  • Chemical System: Ba-O-Ta-Te
  • Density: 6.97436657804172
  • Atomic Density: 0.0667179093180921
  • Unit Cell Volume: 464.6428570206057
  • Molar Volume: 9.026273187440779
  • Full Formula: Ba2 Ta6 Te2 O21
  • Reduced Formula: Ba2Ta6Te2O21
  • Formula Anonymous: A2B2C6D21
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m