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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12740
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Ba', 'Te', 'O']
  • Chemical System: Ba-O-Te
  • Density: 5.9796677064423625
  • Atomic Density: 0.06634147018300458
  • Unit Cell Volume: 271.32350173046444
  • Molar Volume: 9.077490660649781
  • Full Formula: Ba2 Te4 O12
  • Reduced Formula: Ba(TeO3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm