Now showing items 1-2 of 2

    • Thermodynamic stability of non-stoichiometric SrFeO 3-δ : a hybrid DFT study 

      Heifets, Eugene; Kotomin, Eugene A.; Bagaturyants, Alexander; Maier, Joahim (Royal Society of Chemistry, 2019)
      SrFeO3-δ is mixed ionic-electronic conductor with complex magnetic structure which reveals also colossal magnetoresistance effect. This material and its solid solutions are attractive for various spintronic, catalytic and ...
    • Thermodynamic stability of stoichiometric BiFeO3 : hybrid DFT study 

      Heifets, Eugene; Kotomin, Eugene A.; Bagaturyants, A. A.; Maier, Joachim (Royal Society of Chemistry, 2017)
      BiFeO3 perovskite attracts great attention due to its multiferroic properties and potential use as a parent material for Bi1-xSrxFeO3-δ and Bi1-xSrxFe1-yCoyO3-δ solid solutions in intermediate temperature cathodes of oxide ...