Relevance of nonadiabatic effects in TiOCl

We analyze the effect of the phonon dynamics on a recently proposed model for the uniform-incommensurate transition seen in TiOX compounds. The study is based on a recently developed formalism for nonadiabatic spin-Peierls systems based on bosonization and a mean field RPA approximation for the interchain coupling. To reproduce the measured low temperature spin gap, a spin-phonon coupling quite bigger than the one predicted from an adiabatic approach is required. This high value is compatible with the renormalization of the phonons in the high temperature phase seen in inelastic x-ray experiments. Our theory accounts for the temperature of the incommensurate transition and the value of the incommensurate wave vector at the transition point.Comment: 4 pages, 2 figure

Generation of chiral solitons in antiferromagnetic chains by a quantum quench

We analyze the time evolution of a magnetic excitation in a spin-1/2 antiferromagnetic Heisenberg chain after a quantum quench. By a proper modulation of the magnetic exchange coupling, we prepare a static soliton of total spin 1/2 as an initial spin state. Using bosonization and a numerical time dependent density matrix renormalization group algorithm, we show that the initial excitation evolves to a state composed of two counter-propagating chiral states, which interfere to yield = 1/4 for each mode. We find that these dynamically generated states remain considerably stable as time evolution is carried out. We propose spin-Peierls materials and ultracold-atom systems as suitable experimental scenarios in which to conduct and observe this mechanism.Comment: Published version. Title changed due to reinterpretation of results. 5 pages, 4 figure

Noncollinear exchange interaction in transition metal dichalcogenide edges

We study the Ruderman-Kittel-Kasuya-Yosida effective exchange interaction between magnetic impurities embedded on the edges of transition-metal dichalcogenide flakes, using a three-orbital tight-binding model. Electronic states lying midgap of the bulk structure have strong one-dimensional (1D) character, localized on the edges of the crystallite. This results in exchange interactions with $1/r$ (or slower) decay with distance $r$, similar to other 1D systems. Most interestingly, however, the strong spin-orbit interaction in these materials results in sizable non-collinear Dzyaloshinskii-Moriya interactions between impurities, comparable in size to the usual Ising and in-plane components. Varying the relevant Fermi energy by doping or gating may allow one to modulate the effective interactions, controlling the possible helical ground state configurations of multiple impurities.Comment: 5 pages and 4 figure

Kondo effect in graphene with Rashba spin-orbit coupling

We study the Kondo screening of a magnetic impurity adsorbed in graphene in the presence of Rashba spin-orbit interaction. The system is described by an effective single-channel Anderson impurity model, which we analyze using the numerical renormalization group. The nontrivial energy dependence of the host density of states gives rise to interesting behaviors under variation of the chemical potential or the spin-orbit coupling. Varying the Rashba coupling produces strong changes in the Kondo temperature characterizing the many-body screening of the impurity spin, and at half filling allows approach to a quantum phase transition separating the strong-coupling Kondo phase from a free-moment phase. Tuning the chemical potential close to sharp features of the hybridization function results in striking features in the temperature dependences of thermodynamic quantities and in the frequency dependence of the impurity spectral function.Comment: 11 pages, 9 figures. Minor changes. Accepted in PR

Lateral Interfaces of Transition Metal Dichalcogenides: A Stable Tunable One-Dimensional Physics Platform

We study in-plane lateral heterostructures of commensurate transition-metal dichalcogenides, such as MoS$_{2}$-WS$_{2}$ and MoSe$_{2}$-WSe$_{2}$, and find interfacial and edge states that are highly localized to these regions of the heterostructure. These are one-dimensional (1D) in nature, lying within the bandgap of the bulk structure and exhibiting complex orbital and spin structure. We describe such heteroribbons with a three-orbital tight-binding model that uses first principles and experimental parameters as input, allowing us to model realistic systems. Analytical modeling for the 1D interfacial bands results in long-range hoppings due to the hybridization along the interface, with strong spin-orbit couplings. We further explore the Ruderman-Kittel-Kasuya-Yosida indirect interaction between magnetic impurities located at the interface. The unusual features of the interface states result in effective long-range exchange non-collinear interactions between impurities. These results suggest that transition-metal dichalcogenide interfaces could serve as stable, tunable 1D platform with unique properties for possible use in exploring Majorana fermions, plasma excitations and spintronics applications.Comment: 12 pages, 7 figure

Microscopic theory for the incommensurate transition in TiOCl

We propose a microscopic mechanism for the incommensurate phase in TiOX compounds. The model includes the antiferromagnetic chains of Ti ions immersed in the phonon bath of the bilayer structure. Making use of the Cross-Fisher theory, we show that the geometrically frustrated character of the lattice is responsible for the structural instability which leads the chains to an incommensurate phase without an applied magnetic field. In the case of TiOCl, we show that our model is consistent with the measured phonon frequencies at $T=300K$ and the value of the incommensuration vector at the transition temperature. Moreover, we find that the dynamical structure factor shows a progressive softening of an incommensurate phonon near the zone boundary as the temperature decreases. This softening is accompanied by a broadening of the peak which gets asymmetrical as well when going towards the transition temperature. These features are in agreement with the experimental inelastic X-ray measurements.Comment: 6 pages, 5 figures. Published versio

Hybridization and anisotropy in the exchange interaction in three-dimensional Dirac semimetals

We study the Ruderman-Kittel-Kasuya-Yosida interaction in three-dimensional Dirac semimetals. Using retarded Green's functions in real space, we obtain and analyze asymptotic expressions for the interaction, with magnetic impurities at different distances and relative angle with respect to high symmetry directions on the lattice. We show that the Fermi velocity anisotropy in these materials produces a strong renormalization of the magnitude of the interaction, as well as a correction to the frequency of oscillation in real space. Hybridization of the impurities to different conduction electron orbitals are shown to result in interesting anisotropic spin-spin interactions which can generate spiral spin structures in doped samples.Fil: Mastrogiuseppe, Diego Martín. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Rosario. Instituto de Física de Rosario. Universidad Nacional de Rosario. Instituto de Física de Rosario; Argentina. Ohio University; Estados UnidosFil: Sandler, N.. Ohio University; Estados UnidosFil: Ulloa, S. E.. Ohio University; Estados Unido