Density matrix renormalization group studies on one-dimensional -conjugated organic ferromagnet with side radicals

By using the density matrix renormalization group (DMRG) and the self-consistent numerical method, we obtain a high spin ground state with localized spin density describing spin localization and the soliton describing the distortion of the lattice configurations along the main chain. Different electron-phonon interactions result in different configurations of solitons. When the electron-phonon coupling along the main chain is larger than a critical value , a transition from a single soliton-like distortion to a pair of soliton-like distortions along the main chain takes place. Such critical value depends mainly on the intersite Coulomb interactions. The spin density wave along the main chain is always localized around the center of soliton-like distortions. Received 2 July 2001 and Received in final form 25 September 2001     

Electron-phonon coupling spectrum in photodoped pentacene crystals

The coupling between conduction charges and the vibrational modes of the molecular lattice plays a defining role in the transport characteristics of organic semiconductors. Using electron tunneling spectroscopy, we obtain the electron--optical-phonon coupling spectrum in photodoped pentacene crystals at energies <30 meV. Comparison of the tunneling spectrum to infrared absorption data on the optical phonon density of states yields the energy dependence of the electron-phonon scattering matrix element. The integrated spectral weight of the electron-phonon coupling shows that superconductivity in pentacene is likely of electron-phonon origin.     

Ab initio analysis of electron-phonon coupling in molecular devices

We report a first principles analysis of electron-phonon coupling in molecular devices under external bias voltage and during current flow. Our theory and computational framework are based on carrying out density functional theory within the Keldysh nonequilibrium Green's function formalism. Using a molecular tunnel junction of a 1,4-benzenedithiolate molecule contacted by two aluminum leads as an example, we analyze which molecular vibrational modes are most relevant to charge transport under nonequilibrium conditions. We find that the low-lying modes are most important. As a function of bias voltage, the electron-phonon coupling strength can change drastically while the vibrational spectrum changes at a few percent level.     

Many-body effects on the transport properties of single-molecule devices

The conductance through a molecular device including electron-electron and electron-phonon interactions is calculated using the numerical renormalization group method. At low temperatures and weak electron-phonon coupling the properties of the conductance can be explained in terms of the standard Kondo model with renormalized parameters. At large electron-phonon coupling a charge analog of the Kondo effect takes place that can be mapped into an anisotropic Kondo model. In this regime the molecule is strongly polarized by a gate voltage which leads to rectification in the current-voltage characteristics of the molecular junction.     

Theory of light rectification in scanning tunneling microscopy in the presence of an adsorbed molecule

We consider the problem of the rectified current induced by laser radiation in the STM junction when the tip is placed above a small molecule like CO or NO. This is calculated assuming a simple tight-binding model for the tunneling junction including the adsorbate and using nonequilibrium Green's functions techniques. The coupling between tunneling electrons and the molecule vibrational modes is taken into account by a local electron-phonon interaction term. In a second step we estimate the excitation rate of the molecule vibrations for a given laser power. This value is then used to obtain the relative change in the rectified current when the laser is in resonance with a molecule vibration. For a moderate laser power of 2 kW/cm² a relative change of 1 to 3% is predicted.     

Quantum fluctuations in a distributed Josephson junction and the spectral properties of Josephson oscillators

Within the framework of a tunneling Hamiltonian, we obtain an equation for the reduced density matrix to describe quasiclassical dynamics and fluctuation effects in distributed Josephson junctions for voltages comparable with the superconducting gap. For quasiclassical dynamics, we derive the Langevin equation describing in a self-consistent way the resistive state and fluctuations due to both the tunneling current and the electromagnetic field. Current-voltage characteristics of a Josephson oscillator are calculated in the high magnetic field approximation. The intensity and shape of the spectral line of radiation due to vortices moving in a distributed Josephson junction are found.     

脉冲激光烧蚀中电声弛豫时间的确定

为了提高脉冲激光制备薄膜的质量,准确掌握电声弛豫时间是关键,它对脉冲激光脉宽和能量密度的选取起着决定性的作用. 文中以铝靶材为例,利用经典的双温方程通过时域有限差分法(FDTD)得到电子、离子亚系统的温度随时间和位置演化的图像,进而得到电声弛豫时间的准确值. 这样便能准确划分热烧蚀和非平衡烧蚀,从而更好地控制激光的烧蚀过程. 同时找出了电声弛豫时间随激光脉宽以及能量密度变化的规律. 关键词： 飞秒激光 电声弛豫时间 双温方程 激光能量密度     

Tunable superfluidity and quantum magnetism with ultracold polar molecules

By selecting two dressed rotational states of ultracold polar molecules in an optical lattice, we obtain a highly tunable generalization of the t-J model, which we refer to as the t-J-V-W model. In addition to XXZ spin exchange, the model features density-density interactions and density-spin interactions; all interactions are dipolar. We show that full control of all interaction parameters in both magnitude and sign can be achieved independently of each other and of the tunneling. As a first step towards demonstrating the potential of the system, we apply the density matrix renormalization group method to obtain the 1D phase diagram of the simplest experimentally realizable case. Specifically, we show that the tunability and the long-range nature of the interactions in the t-J-V-W model enable enhanced superfluidity. Finally, we show that Bloch oscillations in a tilted lattice can be used to probe the phase diagram experimentally.     

Electric current focusing efficiency in a graphene electric lens

In the present work, we study theoretically the electron wave's focusing phenomenon in a single-layered graphene pn junction (PNJ) and obtain the electric current density distribution of graphene PNJ, which is in good agreement with the qualitative result in previous numerical calculations (Cheianov et al 2007 Science, 315, 1252). In addition, we find that, for a symmetric PNJ, 1/4 of total electric current radiated from the source electrode can be collected by the drain electrode. Furthermore, this ratio reduces to 3/16 in a symmetric graphene npn junction. Our results obtained by the present analytical method provide a general design rule for an electric lens based on negative refractory index systems.     

Importance of electron-phonon processes in the inelastic lifetime of conduction electrons

The temperature of conduction electrons can be raised above the lattice temperature by a high electric current density. The achieved temperature difference is proportional to the electron-phonon relaxation time. Weak localization yields information about the electron temperature and allows the conclusion that electron-phonon processes are an essential determinant for the inelastic lifetime of the conduction electrons.     

Tunneling current spectroscopy of a nanostructure junction involving multiple energy levels

A multilevel Anderson model is employed to simulate the system of a nanostructure tunnel junction with any number of one-particle energy levels. The tunneling current, including both shell-tunneling and shell-filling cases, is theoretically investigated via the nonequilibrium Green's function method. We obtain a closed form for the spectral function, which is used to analyze the complicated tunneling current spectra of a quantum dot or molecule embedded in a double-barrier junction. We also show that negative differential conductance can be observed in a quantum dot tunnel junction when the Coulomb interactions with neighboring quantum dots are taken into account.     

Memory effects in the diffusion of an interacting polydisperse suspension: I. Projection formalism at long wavelength

We consider collective diffusion and self-diffusion in a polydisperse suspension of macroparticles. Using the generalized Smoluchowski equation to describe the interacting suspension we extend Ackerson's work to derive a multispecies projection formalism for the density fluctuations. We include 2-body direct potential interactions as well as accurate 2-body hydrodynamic interactions. We take the long wavelength low density limit of this formalism to obtain an expression for the memory matrix expressed in terms of 2-body interactions and propagators. We show how memory contributions can arise to first order in density from the fact that the correct mobility tensors are not divergenceless.     

Modeling of dynamics of field-induced transformations in charge density waves

We present a modeling of stationary states and their transient dynamic for charge density waves in restricted geometries of realistic junctions under the applied voltage or the passing current. The model takes into account multiple fields in mutual nonlinear interactions: the amplitude and the phase of the charge density wave complex order parameter, distributions of the electric field, the density and the current of normal carriers. The results show that stationary states with dislocations are formed after an initial turbulent multi-vortex process. Static dislocations multiply stepwise when the voltage across or the current through the junction exceed a threshold. The dislocation core forms a charge dipole which concentrates a steep drop of the voltage, thus working as a self-tuned microscopic tunnelling junction. That can gives rise to features observed in experiments on the inter-layer tunneling in mesa-junctions.     

Transverse spin current in the s-wave/p-wave Josephson junction

We report a theoretical study on spin transport in the hybrid Josephson junction composed of singlet s-wave and triplet p-wave superconductor. The node of the triplet pair potential is considered perpendicular to the interface of the junction. Based on a symmetry analysis, we predict that there is no net spin density at the interface of the junction but instead a transverse mode-resolved spin density can exist and a nonzero spin current can flow transversely along the interface of the junction. The predictions are numerically demonstrated by means of the lattice Matsubara Green's function method. It is also shown that, when a normal metal is sandwiched in between two superconductors, both spin current and transverse mode-resolved spin density are only residing at two interfaces due to the smearing effect of the multimode transport. Our findings are useful for identifying the pairing symmetry of the p-wave superconductor and generating spin current.     

Superconducting and charge-density wave instabilities in ultrasmall-radius carbon nanotubes

We perform a detailed analysis of the band structure, phonon dispersion, and electron-phonon coupling of three types of small-radius carbon nanotubes (CNTs): (5,0), (6,0), and (5,5) with diameters 3.9, 4.7, and 6.8 Å respectively. The large curvature of the (5,0) CNTs makes them metallic with a large density of states at the Fermi energy. The density of states is also strongly enhanced for the (6,0) CNTs compared to the results obtained from the zone-folding method. For the (5,5) CNTs the electron-phonon interaction is dominated by the in-plane optical phonons, while for the ultrasmall (5,0) and (6,0) CNTs the main coupling is to the out-of-plane optical phonon modes. We calculate electron-phonon interaction strengths for all three types of CNTs and analyze possible instabilities toward superconducting and charge-density wave phases. For the smallest (5,0) nanotube, in the mean-field approximation and neglecting Coulomb interactions, we find that the charge-density wave transition temperature greatly exceeds the superconducting one. When we include a realistic model of the Coulomb interaction we find that the charge-density wave is suppressed to very low temperatures, making superconductivity dominant with the mean-field transition temperature around one K. For the (6,0) nanotube the charge-density wave dominates even with the inclusion of Coulomb interactions and we find the mean-field transition temperature to be around five Kelvin. We find that the larger radius (5,5) nanotube is stable against superconducting and charge-density wave orders at all realistic temperatures.     

Temperature dependence of the angle resolved photoemission spectra in the undoped cuprates: self-consistent approach to the t-J Holstein model

We develop a novel self-consistent approach for studying the angle resolved photoemission spectra (ARPES) of a hole in the t-J Holstein model giving perfect agreement with numerically exact diagrammatic Monte Carlo (DMC) data at zero temperature for all regimes of electron-phonon coupling. Generalizing the approach to finite temperatures, we find that the anomalous temperature dependence of the ARPES in undoped cuprates is explained by cooperative interplay of coupling of the hole to magnetic fluctuations and strong electron-phonon interaction.     

Electromagnetically induced transparency in asymmetric double quantum wells

We show how to compute nonlinear optical absorption spectra of an Asymmetric Double Quantum Well (ADQW) in the region of intersubband electronic transitions. The method uses the microscopic calculation of the dephasing due to electron-electron and electron-phonon scattering rates and the macroscopic real density matrix approach to compute the electromagnetic fields and susceptibilities. The polarization dephasing and the corrections to the Rabi frequencies due to the electron-electron interaction are also taken into account. For a proper choice of the QW widths and of the driving fields we obtain electromagnetically induced transparency. This transparency has a very narrow linewidth when a single driving field is applied resonant to the transition between the second and the third subband. In the case of two resonant driving fields or of a driving field resonant between the first and third subband we obtain a large transparency enhancement over the entire absorption spectrum. Results are given for GaAs/GaAlAs QWs and experiments are proposed. Received 21 June 2001 and Received in final form 21 January 2002     

A Non-Equilibrium Approach to Coupled-Mode-Induced Hot-Electron Energy Loss Rate

Hot-electron energy loss to the lattice through electron-phonon interactions is studied using Keldysh closed-time-path Green's functions. To the lowest order in electron-phonon coupling, Kogan's formula for the energy-loss rate is obtained. When higher order interactions are included, however, we find that the coupled-mode contribution is exactly zero.     

A geometric wave function for a few interacting bosons in a harmonic trap

We establish a new geometric wave function that combined with a variational principle efficiently describes a system of bosons interacting in a one-dimensional trap. By means of a combination of the exact wave function solution for contact interactions and the asymptotic behavior of the harmonic potential solution we obtain the ground state energy, probability density and profiles of a few boson system in a harmonic trap. We are able to access all regimes, ranging from the strongly attractive to the strongly repulsive one with an original and simple formulation.     

Interactions and disorder in quantum dots: instabilities and phase transitions

Using a fermionic renormalization group approach, we analyze a model where the electrons diffusing on a quantum dot interact via Fermi-liquid interactions. Describing the single-particle states by random matrix theory, we find that interactions can induce phase transitions (or crossovers for finite systems) to regimes where fluctuations and collective effects dominate at low energies. Implications for experiments and numerical work on quantum dots are discussed.