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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104687
  • 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: 10
  • Number of elements: 4
  • Element list: ['Ta', 'Mn', 'Fe', 'O']
  • Chemical System: Fe-Mn-O-Ta
  • Density: 6.632408190531463
  • Atomic Density: 0.09022909498197301
  • Unit Cell Volume: 110.82899592418512
  • Molar Volume: 6.6742781374490905
  • Full Formula: Ta1 Mn2 Fe1 O6
  • Reduced Formula: TaMn2FeO6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 146
  • Spacegroup Symbol: R3H
  • Crystal System: trigonal
  • Pointgroup: 3