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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35945
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 2
  • Element list: ['Ta', 'O']
  • Chemical System: O-Ta
  • Density: 6.139956368090539
  • Atomic Density: 0.06460155425535585
  • Unit Cell Volume: 247.67205966524412
  • Molar Volume: 9.321975035145115
  • Full Formula: Ta4 O12
  • Reduced Formula: TaO3
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m