Electron gas with polaronic effects: beyond the mean-field theory

The occurrence of polaronic behaviour in real solids is often accompanied by strong exchange and correlation effects in the electron gas besides being strongly entangled to the phononic degrees of freedom. Such effects can be relevant for the instability towards Wigner crystallization or charge density waves, or yet for the polaron role in high-T(C) superconductors and in manganites. The inclusion of exchange and correlation in the coupled electron-phonon system is thus highly desirable. In this work, we exploit the density functional theory and its time-dependent extension to construct an appropriate effective potential useful for studying the properties of interacting polarons. The validity and the possible developments of this approach are discussed, and future applications are proposed

Strain effect on orbital and magnetic structures of Mn ions in epitaxial Nd0.35Sr0.65MnO3/SrTiO3 films using X-ray diffraction and absorption

[[abstract]]This study probes the temperature-dependent strain that is strongly correlated with the orbital and magnetic structures of epitaxial films of Nd0.35Sr0.65MnO3 (NSMO) that are fabricated by pulsed laser deposition with two thicknesses, 17 (NS17) and 103 nm (NS103) on SrTiO3 (STO) substrate. This investigation is probed using X-ray diffraction (XRD) and absorption-based techniques, X-ray linear dichroism (XLD) and the X-ray magnetic circular dichroism (XMCD). XRD indicates a significant shift in the (004) peak position that is associated with larger strain in NS17 relative to that of NS103 at both 30 and 300 K. Experimental and atomic multiplet simulated temperature-dependent Mn L3,2-edge XLD results reveal that the stronger strain in a thinner NS17 film causes less splitting of Mn 3d eg state at low temperature, indicating an enhancement of orbital fluctuations in the band above the Fermi level. This greater Mn 3d orbital fluctuation can be the cause of both the enhanced ferromagnetism (FM) as a result of spin moments and the reduced Néel temperature of C-type antiferromagnetism (AFM) in NS17, leading to the FM coupling of the canted-antiferromagnetism (FM-cAFM) state in NSMO/STO epitaxial films at low temperature (T = 30 K). These findings are also confirmed by Mn L3,2-edge XMCD measurements.[[notice]]補正完