Charge dynamics in thermally and doping induced insulator-metal transitions of (Ti1-xVx)2O3

Charge dynamics of (Ti1-xVx)2O3 with x=0-0.06 has been investigated by measurements of charge transport and optical conductivity spectra in a wide temperature range of 2-600K with the focus on the thermally and doping induced insulator-metal transitions (IMTs). The optical conductivity peaks for the interband transitions in the 3d t2g manifold are observed in the both insulating and metallic states, while their large variation (by ~0.4 eV) with change of temperature and doping level scales with that of the Ti-Ti dimer bond length, indicating the weakened singlet bond in the course of IMTs. The thermally and V-doping induced IMTs are driven with the increase in carrier density by band-crossing and hole-doping, respectively, in contrast to the canonical IMT of correlated oxides accompanied by the whole collapse of the Mott gap.Comment: 4 pages, 4 figure

Moving embedded lattice solitons

It was recently proved that isolated unstable "embedded lattice solitons" (ELS) may exist in discrete systems. The discovery of these ELS gives rise to relevant questions such as the following: are there continuous families of ELS?, can ELS be stable?, is it possible for ELS to move along the lattice?, how do ELS interact?. The present work addresses these questions by showing that a novel differential-difference equation (a discrete version of a complex mKdV equation) has a two-parameter continuous family of exact ELS. The numerical tests reveal that these solitons are stable and robust enough to withstand collisions. The model may apply to the description of a Bose-Einstein condensate with dipole-dipole interactions between the atoms, trapped in a deep optical-lattice potential.Comment: 13 pages, 11 figure

A statistical model approximation for perovskite solid-solutions: a Raman study of lead-zirconate-titanate single crystal

Lead titanate (PbTiO3) is a classical example of a ferroelectric perovskite oxide illustrating a displacive phase transition accompanied by a softening of a symmetry-breaking mode. The underlying assumption justifying the soft-mode theory is that the crystal is macroscopically sufficiently uniform so that a meaningful free energy function can be formed. In contrast to PbTiO3, experimental studies show that the phase transition behaviour of lead-zirconate-titanate solid solution (PZT) is far more subtle. Most of the studies on the PZT system have been dedicated to ceramic or powder samples, in which case an unambiguous soft-mode study is not possible, as modes with different symmetries appear together. Our Raman scattering study on titanium-rich PZT single crystal shows that the phase transitions in PZT cannot be described by a simple soft-mode theory. In strong contrast to PbTiO3, splitting of transverse E-symmetry modes reveals that there are different locally-ordered regions. The role of crystal defects, random distribution of Ti and Zr at the B-cation site and Pb ions shifted away from their ideal positions, dictates the phase transition mechanism. A statistical model explaining the observed peak splitting and phase transformation to a complex state with spatially varying local order in the vicinity of the morphotropic phase boundary is given.Comment: Article contains four black-and-white figures, one colour figure and one Table. Symmetry analysis and details of the model are given in Appendices I and II, respectivel

Critical enhancement of thermopower in a chemically tuned polar semimetal MoTe2_{\bf 2}

Ferroelectrics with spontaneous electric polarization play an essential role in today's device engineering, such as capacitors and memories. Their physical properties are further enriched by suppressing the long-range polar order, as is exemplified by quantum paraelectrics with giant piezoelectric and dielectric responses at low temperatures. Likewise in metals, a polar lattice distortion has been theoretically predicted to give rise to various unusual physical properties. So far, however, a "ferroelectric"-like transition in metals has seldom been controlled and hence its possible impacts on transport phenomena remain unexplored. Here we report the discovery of anomalous enhancement of thermopower near the critical region between the polar and nonpolar metallic phases in 1T'-Mo$_{1-x}$Nb$_{x}$Te$_2$ with a chemically tunable polar transition. It is unveiled from the first-principles calculations and magnetotransport measurements that charge transport with strongly energy-dependent scattering rate critically evolves towards the boundary to the nonpolar phase, resulting in large cryogenic thermopower. Such a significant influence of the structural instability on transport phenomena might arise from the fluctuating or heterogeneous polar metallic states, which would pave a novel route to improving thermoelectric efficiency.Comment: 26 pages, 4 figure