arXiv subjects

Michael Schreiber

Publications and source records attributed to Michael Schreiber.

At least 127 records · Page 7Linked to original sources

arXiv2001

Fock space localization, return probability, and conductance of disordered interacting electrons

We numerically simulate the low-energy properties of interacting electrons in a random potential using the Hartree-Fock based exact diagonalization method. In particular, we investigate how the transport properties are influenced by the combined effects of disorder and correlations in the presence of the electron spin. To this end we calculate the participation number of many-particle states in Fock space, the return probability of single-particle excitations, and the Kubo-Greenwood conductance. It turns out that in the strongly localized regime interactions increase the conductance whereas for weak disorder interactions decrease the conductance. In contrast, single-particle excitations in general experience a localizing influence of the interactions.

cond-mat.dis-nn↗

arXiv2000

Perturbative treatment of intercenter coupling in Redfield theory

The quantum dynamics of coupled subsystems connected to a thermal bath is studied. In some of the earlier work the effect of intercenter coupling on the dissipative part was neglected. This is equivalent to a zeroth-order perturbative expansion of the damping term with respect to the intercenter coupling. It is shown numerically for two coupled harmonic oscillators that this treatment can lead to artifacts and a completely wrong description, for example, of a charge transfer processes even for very weak intercenter coupling. Here we perform a first-order treatment and show that these artifacts disappear. In addition, we demonstrate that the thermodynamic equilibrium population is almost reached even for strong intercenter coupling strength.

physics.chem-ph↗

arXiv2000

Dynamical Scaling Properties of Electrons in Quantum Systems with Multifractal Eigenstates

We study the intricate relationships between the dynamical scaling properties of electron wave packets and the multifractality of the eigenstates in quantum systems. Numerical simulations for the Harper model and the Fibonacci chain indicate that the root mean square displacement displays the scaling behavior $r(t)\sim t^β$ with $β=D_2^ψ$, where $D_2^ψ$ is the correlation dimension of the multifractal eigenstates. The equality can be generalized to $d$-dimensional systems as $β=D_2^ψ/d$, as long as the electron motion is ballistic in the effective $D_2^ψ$-dimensional space. This equality should be replaced by $β<D_2^ψ/d$ if the motion is non-ballistic, as supported by all known results.

cond-mat.dis-nn↗

arXiv2000

Disorder and Two-Particle Interaction in Low-Dimensional Quantum Systems

We review some of the recent results on two-interacting particles (TIP) in low-dimensional disordered quantum models. Special attention is given to the mapping of the problem onto random band matrices. In particular, we construct two simple, seemingly closely related examples for which an analogous mapping leads to incorrect results. We briefly discuss possible reasons for this discrepancy based on the physical differences between the TIP problem and our examples.

cond-mat.dis-nn↗

arXiv2000

Efficiency of different numerical methods for solving Redfield equations

The numerical efficiency of different schemes for solving the Liouville-von Neumann equation within multilevel Redfield theory has been studied. Among the tested algorithms are the well-known Runge-Kutta scheme in two different implementations as well as methods especially developed for time propagation: the Short Iterative Arnoldi, Chebyshev and Newtonian propagators. In addition, an implementation of a symplectic integrator has been studied. For a simple example of a two-center electron transfer system we discuss some aspects of the efficiency of these methods to integrate the equations of motion. Overall for time-independent potentials the Newtonian method is recommended. For time-dependent potentials implementations of the Runge-Kutta algorithm are very efficient.

physics.chem-ph↗

arXiv2000

Trace and antitrace maps for aperiodic sequences, their extensions and applications

We study aperiodic systems based on substitution rules by means of a transfer-matrix approach. In addition to the well-known trace map, we investigate the so-called `antitrace' map, which is the corresponding map for the difference of the off-diagonal elements of the 2x2 transfer matrix. The antitrace maps are obtained for various binary, ternary and quaternary aperiodic sequences, such as the Fibonacci, Thue-Morse, period-doubling, Rudin-Shapiro sequences, and certain generalizations. For arbitrary substitution rules, we show that not only trace maps, but also antitrace maps exist. The dimension of the our antitrace map is r(r+1)/2, where r denotes the number of basic letters in the aperiodic sequence. Analogous maps for specific matrix elements of the transfer matrix can also be constructed, but the maps for the off-diagonal elements and for the difference of the diagonal elements coincide with the antitrace map. Thus, from the trace and antitrace map, we can determine any physical quantity related to the global transfer matrix of the system. As examples, we employ these dynamical maps to compute the transmission coefficients for optical multilayers, harmonic chains, and electronic systems.

cond-mat.dis-nn↗

arXiv2000

Energy spectra, wavefunctions and quantum diffusion for quasiperiodic systems

We study energy spectra, eigenstates and quantum diffusion for one- and two-dimensional quasiperiodic tight-binding models. As our one-dimensional model system we choose the silver mean or `octonacci' chain. The two-dimensional labyrinth tiling, which is related to the octagonal tiling, is derived from a product of two octonacci chains. This makes it possible to treat rather large systems numerically. For the octonacci chain, one finds singular continuous energy spectra and critical eigenstates which is the typical behaviour for one-dimensional Schr"odinger operators based on substitution sequences. The energy spectra for the labyrinth tiling can, depending on the strength of the quasiperiodic modulation, be either band-like or fractal-like. However, the eigenstates are multifractal. The temporal spreading of a wavepacket is described in terms of the autocorrelation function C(t) and the mean square displacement d(t). In all cases, we observe power laws for C(t) and d(t) with exponents -delta and beta, respectively. For the octonacci chain, 0<delta<1, whereas for the labyrinth tiling a crossover is observed from delta=1 to 0<delta<1 with increasing modulation strength. Corresponding to the multifractal eigenstates, we obtain anomalous diffusion with 0<beta<1 for both systems. Moreover, we find that the behaviour of C(t) and d(t) is independent of the shape and the location of the initial wavepacket. We use our results to check several relations between the diffusion exponent beta and the fractal dimensions of energy spectra and eigenstates that were proposed in the literature.

cond-mat.dis-nn↗

arXiv2000

Exponents of the localization lengths in the bipartite Anderson model with off-diagonal disorder

We investigate the scaling properties of the two-dimensional (2D) Anderson model of localization with purely off-diagonal disorder (random hopping). In particular, we show that for small energies the infinite-size localization lengths as computed from transfer-matrix methods together with finite-size scaling diverge with a power-law behavior. The corresponding exponents seem to depend on the strength and the type of disorder chosen.

cond-mat.dis-nn↗

arXiv2000

From localization to delocalization in the quantum Coulomb glass

We numerically investigate how electron-electron interactions influence the transport properties of disordered electrons in two dimensions. Our study is based on the quantum Coulomb glass model appropriately generalized to include the spin degrees of freedom. In order to obtain the low-energy properties of this model we employ the Hartree-Fock based diagonalization, an efficient numerical method similar to the configuration interaction approach in quantum chemistry. We calculate the d.c. conductance by means of the Kubo-Greenwood formula and pay particular attention to the spin degrees of freedom. In agreement with earlier results we find that electron-electron interactions can cause delocalization. For spinful electrons this delocalization is significantly larger than for spinless electrons.

cond-mat.str-el↗

arXiv2000

Energy-level statistics at the metal-insulator transition in anisotropic systems

We study the three-dimensional Anderson model of localization with anisotropic hopping, i.e. weakly coupled chains and weakly coupled planes. In our extensive numerical study we identify and characterize the metal-insulator transition using energy-level statistics. The values of the critical disorder $W_c$ are consistent with results of previous studies, including the transfer-matrix method and multifractal analysis of the wave functions. $W_c$ decreases from its isotropic value with a power law as a function of anisotropy. Using high accuracy data for large system sizes we estimate the critical exponent $ν=1.45\pm0.2$. This is in agreement with its value in the isotropic case and in other models of the orthogonal universality class. The critical level statistics which is independent of the system size at the transition changes from its isotropic form towards the Poisson statistics with increasing anisotropy.

cond-mat.dis-nn↗

arXiv2000

Integrable impurities for an open fermion chain

Employing the graded versions of the Yang-Baxter equation and the reflection equations, we construct two kinds of integrable impurities for a small-polaron model with general open boundary conditions: (a) we shift the spectral parameter of the local Lax operator at arbitrary sites in the bulk, and (b) we embed the impurity fermion vertex at each boundary of the chain. The Hamiltonians with different types of impurity terms are given explicitly. The Bethe ansatz equations, as well as the eigenvalues of the Hamiltonians, are constructed by means of the quantum inverse scattering method. In addition, we discuss the ground-state properties in the thermodynamic limit.

nlin.SI↗

arXiv2000

Photo-induced intermolecular charge transfer in porphyrin complexes

Optical excitation of the sequential supermolecule H_2P-ZnP-Q induces an electron transfer from the free-base porphyrin (H_2P) to the quinone (Q) via the zinc porphyrin (ZnP). This process is modeled by equations of motion for the reduced density matrix which are solved numerically and approximately analytically. These two solutions agree very well in a great region of parameter space. It is shown that for the majority of solvents the electron transfer occurs with the superexchange mechanism.

physics.chem-ph↗

arXiv1999

Critical properties of the metal-insulator transition in anisotropic systems

We study the three-dimensional Anderson model of localization with anisotropic hopping, i.e., weakly coupled chains and weakly coupled planes. In our extensive numerical study we identify and characterize the metal-insulator transition by means of the transfer-matrix method. The values of the critical disorder $W_c$ obtained are consistent with results of previous studies, including multifractal analysis of the wave functions and energy level statistics. $W_c$ decreases from its isotropic value with a power law as a function of anisotropy. Using high accuracy data for large system sizes we estimate the critical exponent as $ν=1.62\pm0.07$. This is in agreement with its value in the isotropic case and in other models of the orthogonal universality class.

cond-mat.dis-nn↗

arXiv1999

Crossover from interaction induced localization to delocalization in disordered electron systems

We numerically investigate the transport properties of interacting spinless electrons in disordered systems. We use an efficient method which is based on the diagonalization of the Hamiltonian in the subspace of the many-particle Hilbert space which is spanned by the low-energy Slater states. Low-energy properties can be calculated with an accuracy comparable to that of exact diagonalization but for larger system sizes. The method works well in the entire parameter space, and it can handle long-range as well as short-range interactions. Using this method we calculate the combined effect of disorder and interactions on the Kubo-Greenwood conductance and on the sensitivity of the ground state energy to a twist in the boundary conditions. We find that the influence of the interactions on the transport properties is opposite for large and small disorder. In the strongly localized regime (small kinetic energy, large disorder) interactions increase the transport whereas for weak disorder (large kinetic energy) interactions decrease the transport.

cond-mat.mes-hall↗

arXiv1999

Planar quasiperiodic Ising models

We investigate zero-field Ising models on periodic approximants of planar quasiperiodic tilings by means of partition function zeros and high-temperature expansions. These are obtained by employing a determinant expression for the partition function. The partition function zeros in the complex temperature plane yield precise estimates of the critical temperature of the quasiperiodic model. Concerning the critical behaviour, our results are compatible with Onsager universality, in agreement with the Harris-Luck criterion based on scaling arguments.

cond-mat.stat-mech↗

arXiv1999

Universal level-spacing statistics in quasiperiodic tight-binding models

We study statistical properties of the energy spectra of two-dimensional quasiperiodic tight-binding models. The multifractal nature of the eigenstates of these models is corroborated by the scaling of the participation numbers with the systems size. Hence one might have expected `critical' or `intermediate' statistics for the level-spacing distributions as observed at the metal-insulator transition in the three-dimensional Anderson model of disorder. However, our numerical results are in perfect agreement with the universal level-spacing distributions of the Gaussian orthogonal random matrix ensemble, including the distribution of spacings between second, third, and forth neighbour energy levels.

cond-mat.dis-nn↗

arXiv1999

Aperiodic Tilings on the Computer

We briefly review the standard methods used to construct quasiperiodic tilings, such as the projection, the inflation, and the grid method. A number of sample Mathematica programs, implementing the different approaches for one- and two-dimensional examples, are discussed. Apart from small examples, the corresponding programs are not contained in the text, but will be made available in electronic form.

cond-mat.mtrl-sci↗

arXiv1999

High-temperature expansion for Ising models on quasiperiodic tilings

We consider high-temperature expansions for the free energy of zero-field Ising models on planar quasiperiodic graphs. For the Penrose and the octagonal Ammann-Beenker tiling, we compute the expansion coefficients up to 18th order. As a by-product, we obtain exact vertex-averaged numbers of self-avoiding polygons on these quasiperiodic graphs. In addition, we analyze periodic approximants by computing the partition function via the Kac-Ward determinant. For the critical properties, we find complete agreement with the commonly accepted conjecture that the models under consideration belong to the same universality class as those on periodic two-dimensional lattices.

cond-mat.stat-mech↗