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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-13820
  • 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: 6
  • Number of elements: 3
  • Element list: ['Ta', 'Mn', 'O']
  • Chemical System: Mn-O-Ta
  • Density: 8.957692525411119
  • Atomic Density: 0.0955270759728639
  • Unit Cell Volume: 62.80941752791012
  • Molar Volume: 6.304119223444767
  • Full Formula: Ta1 Mn2 O3
  • Reduced Formula: TaMn2O3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm