Amritendu Roy, Rajendra Prasad, Sushil Auluck, Ashish Garg
Here, we report a combined experimental-theoretical study showing that collective application of rare earth doping on A-site and epitaxial strain to ferroelectric bismuth titanate does not lead to a very large c-axis polarization as reported previously. Further first principles calculations based on the examination of polarization tensor suggest that simultaneous Bi and Ti site doping could result in moderate polarization along c-axis of bismuth titanate which is typically a preferential axis of film growth and thus enabling c axis oriented films to have appreciable polarization. This approach could also be applicable to other ferroic oxides where one can correlate the doping, epitaxial strain, and polarization to design materials compositions resulting in epitaxial films grown along desired directions yielding substantial polarization.
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http://arxiv.org/abs/1301.5743
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