Comparative study of density functional theories of the exchange-correlation hole and energy in silicon

We present a detailed study of the exchange-correlation hole and exchange-correlation energy per particle in the Si crystal as calculated by the Variational Monte Carlo method and predicted by various density functional models. Nonlocal density averaging methods prove to be successful in correcting severe errors in the local density approximation (LDA) at low densities where the density changes dramatically over the correlation length of the LDA hole, but fail to provide systematic improvements at higher densities where the effects of density inhomogeneity are more subtle. Exchange and correlation considered separately show a sensitivity to the nonlocal semiconductor crystal environment, particularly within the Si bond, which is not predicted by the nonlocal approaches based on density averaging. The exchange hole is well described by a bonding orbital picture, while the correlation hole has a significant component due to the polarization of the nearby bonds, which partially screens out the anisotropy in the exchange hole.Comment: 16 pages, 5 figures, RevTeX, added conten

Photonic band structure of highly deformable, self-assembling systems

We calculate the photonic band structure at normal incidence of highly deformable, self-assembling systems - cholesteric elastomers subjected to external stress. Cholesterics display brilliant reflection and lasing owing to gaps in their photonic band structure. The band structure of cholesteric elastomers varies sensitively with strain, showing new gaps opening up and shifting in frequency. A novel prediction of a total band gap is made, and is expected to occur in the vicinity of the previously observed de Vries bandgap, which is only for one polarisation

Dielectrophoresis of charged colloidal suspensions

We present a theoretical study of dielectrophoretic (DEP) crossover spectrum of two polarizable particles under the action of a nonuniform AC electric field. For two approaching particles, the mutual polarization interaction yields a change in their respective dipole moments, and hence, in the DEP crossover spectrum. The induced polarization effects are captured by the multiple image method. Using spectral representation theory, an analytic expression for the DEP force is derived. We find that the mutual polarization effects can change the crossover frequency at which the DEP force changes sign. The results are found to be in agreement with recent experimental observation and as they go beyond the standard theory, they help to clarify the important question of the underlying polarization mechanisms

Image forces on screw dislocations in multilayer structures

Peer Reviewedhttp://deepblue.lib.umich.edu/bitstream/2027.42/26533/1/0000072.pd

Allowed Gamow-Teller Excitations from the Ground State of 14N

Motivated by the proposed experiment $^{14}N(d,{^2He})^{14}C$, we study the final states which can be reached via the allowed Gamow-Teller mechanism. Much emphasis has been given in the past to the fact that the transition matrix element from the $J^{\pi}=1^+ T=0$ ground state of $^{14}N$ to the $J^{\pi}=0^+ T=1$ ground state of $^{14}C$ is very close to zero, despite the fact that all the quantum numbers are right for an allowed transition. We discuss this problem, but, in particular, focus on the excitations to final states with angular momenta $1^+$ and $2^+$. We note that the summed strength to the $J^{\pi}=2^+ T=1$ states, calculated with a wide variety of interactions, is significantly larger than that to the $J^{\pi}=1^+ T=1$ final states.Comment: Submitted to Phys. Rev.

Efficient photoionization for barium ion trapping using a dipole-allowed resonant two-photon transition

Two efficient and isotope-selective resonant two-photon ionization techniques for loading barium ions into radio-frequency (RF)-traps are demonstrated. The scheme of using a strong dipole-allowed transition at \lambda=553 nm as a first step towards ionization is compared to the established technique of using a weak intercombination line (\lambda=413 nm). An increase of two orders of magnitude in the ionization efficiency is found favoring the transition at 553 nm. This technique can be implemented using commercial all-solid-state laser systems and is expected to be advantageous compared to other narrowband photoionization schemes of barium in cases where highest efficiency and isotope-selectivity are required.Comment: 8 pages, 5 figure

Generic Rotation in a Collective SD Nucleon-Pair Subspace

Low-lying collective states involving many nucleons interacting by a random ensemble of two-body interactions (TBRE) are investigated in a collective SD-pair subspace, with the collective pairs defined dynamically from the two-nucleon system. It is found that in this truncated pair subspace collective vibrations arise naturally for a general TBRE hamiltonian whereas collective rotations do not. A hamiltonian restricted to include only a few randomly generated separable terms is able to produce collective rotational behavior, as long as it includes a reasonably strong quadrupole-quadrupole component. Similar results arise in the full shell model space. These results suggest that the structure of the hamiltonian is key to producing generic collective rotation.Comment: 11 pages, 5 figure

Decoherence and Initial Correlations in Quantum Brownian Motion

We analyze the evolution of a quantum Brownian particle starting from an initial state that contains correlations between this system and its environment. Using a path integral approach, we obtain a master equation for the reduced density matrix of the system finding relatively simple expressions for its time dependent coefficients. We examine the evolution of delocalized initial states (Schr\"odinger's cats) investigating the effectiveness of the decoherence process. Analytic results are obtained for an ohmic environment (Drude's model) at zero temperature.Comment: 15 pages, RevTex, 5 figures included. Submitted to Phys. Rev.

Third-order relativistic many-body calculations of energies and lifetimes of levels along the silver isoelectronic sequence

Energies of 5l_j (l= s, p, d, f, g) and 4f_j states in neutral Ag and Ag-like ions with nuclear charges Z = 48 - 100 are calculated using relativistic many-body perturbation theory. Reduced matrix elements, oscillator strengths, transition rates and lifetimes are calculated for the 17 possible 5l_j-5l'_{j'} and 4f_j-5l_{j'} electric-dipole transitions. Third-order corrections to energies and dipole matrix elements are included for neutral Ag and for ions with Z60. Comparisons are made with available experimental data for transition energies and lifetimes. Correlation energies and transition rates are shown graphically as functions of nuclear charge Z for selected cases. These calculations provide a theoretical benchmark for comparison with experiment and theory.Comment: 8 page

Fluctuations and Dissipation of Coherent Magnetization

A quantum mechanical model is used to derive a generalized Landau-Lifshitz equation for a magnetic moment, including fluctuations and dissipation. The model reproduces the Gilbert-Brown form of the equation in the classical limit. The magnetic moment is linearly coupled to a reservoir of bosonic degrees of freedom. Use of generalized coherent states makes the semiclassical limit more transparent within a path-integral formulation. A general fluctuation-dissipation theorem is derived. The magnitude of the magnetic moment also fluctuates beyond the Gaussian approximation. We discuss how the approximate stochastic description of the thermal field follows from our result. As an example, we go beyond the linear-response method and show how the thermal fluctuations become anisotropy-dependent even in the uniaxial case.Comment: 22 page