Computer simulations of two-dimensional melting with dipole-dipole interactions

We perform molecular dynamics and Monte Carlo simulations of two-dimensional melting with dipole-dipole interactions. Both static and dynamic behaviors are examined. In the isotropic liquid phase, the bond orientational correlation length 6 and susceptibility 6 are measured, and the data are fitted to the theoretical ansatz. An algebraic decay is detected for both spatial and temporal bond orientational correlation functions in an intermediate temperature regime, and it provides an explicit evidence for the existence of the hexatic phase. From the finite-size scaling analysis of the global bond orientational order parameter, the disclination unbinding temperature Ti is estimated. In addition, from dynamic Monte Carlo simulations of the positional order parameter, we extract the critical exponents at the dislocation unbinding temperature Tm. All the results are in agreement with those from experiments and support the Kosterlitz-Thouless-Halperin-Nelson-Young (KTHNY) theory.Comment: 23 pages, 12figure

Systematic {\it ab initio} study of the magnetic and electronic properties of all 3d transition metal linear and zigzag nanowires

It is found that all the zigzag chains except the nonmagnetic (NM) Ni and antiferromagnetic (AF) Fe chains which form a twisted two-legger ladder, look like a corner-sharing triangle ribbon, and have a lower total energy than the corresponding linear chains. All the 3d transition metals in both linear and zigzag structures have a stable or metastable ferromagnetic (FM) state. The electronic spin-polarization at the Fermi level in the FM Sc, V, Mn, Fe, Co and Ni linear chains is close to 90% or above. In the zigzag structure, the AF state is more stable than the FM state only in the Cr chain. It is found that the shape anisotropy energy may be comparable to the electronic one and always prefers the axial magnetization in both the linear and zigzag structures. In the zigzag chains, there is also a pronounced shape anisotropy in the plane perpendicular to the chain axis. Remarkably, the axial magnetic anisotropy in the FM Ni linear chain is gigantic, being ~12 meV/atom. Interestingly, there is a spin-reorientation transition in the FM Fe and Co linear chains when the chains are compressed or elongated. Large orbital magnetic moment is found in the FM Fe, Co and Ni linear chains

Interstitials, Vacancies, and Supersolid Order in Vortex Crystals

Interstitials and vacancies in the Abrikosov phase of clean Type II superconductors are line imperfections, which cannot extend across macroscopic equilibrated samples at low temperatures. We argue that the entropy associated with line wandering nevertheless can cause these defects to proliferate at a sharp transition which will exist if this occurs below the temperature at which the crystal actually melts. Vortices are both entangled and crystalline in the resulting ``supersolid'' phase, which in a dual ``boson'' analog system is closely related to a two-dimensional quantum crystal of He$^4$ with interstitials or vacancies in its ground state. The supersolid {\it must} occur for $B\gg B_\times$, where $B_\times$ is the decoupling field above which vortices begin to behave two-dimensionally. Numerical calculations show that interstitials, rather than vacancies, are the preferred defect for $B\gg \phi_0/\lambda_\perp^2$, and allow us to estimate whether proliferation also occurs for B\,\lot\,B_\times.The implications of the supersolid phase for transport measurements, dislocation configurations and neutron diffraction are discussed.Comment: 53 pages and 15 figures, available upon request, written in plain TE

On homogenization of electromagnetic crystals formed by uniaxial resonant scatterers

Dispersion properties of electromagnetic crystals formed by small uniaxial resonant scatterers (magnetic or electric) are studied using the local field approach. The goal of the study is to determine the conditions under which the homogenization of such crystals can be made. Therefore the consideration is limited by the frequency region where the wavelength in the host medium is larger than the lattice periods. It is demonstrated that together with known restriction for the homogenization related with the large values of the material parameters there is an additional restriction related with their small absolute values. From the other hand, the homogenization becomes allowed in both cases of large and small material parameters for special directions of propagation. Two unusual effects inherent to the crystals under consideration are revealed: flat isofrequency contour which allows subwavelength imaging using canalization regime and birefringence of extraordinary modes which can be used for beam splitting.Comment: 16 pages, 12 figures, submitted to PR

Spatiotemporal Response of Crystals in X-ray Bragg Diffraction

The spatiotemporal response of crystals in x-ray Bragg diffraction resulting from excitation by an ultra-short, laterally confined x-ray pulse is studied theoretically. The theory presents an extension of the analysis in symmetric reflection geometry [1] to the generic case, which includes Bragg diffraction both in reflection (Bragg) and transmission (Laue) asymmetric scattering geometries. The spatiotemporal response is presented as a product of a crystal-intrinsic plane wave spatiotemporal response function and an envelope function defined by the crystal-independent transverse profile of the incident beam and the scattering geometry. The diffracted wavefields exhibit amplitude modulation perpendicular to the propagation direction due to both angular dispersion and the dispersion due to Bragg's law. The characteristic measure of the spatiotemporal response is expressed in terms of a few parameters: the extinction length, crystal thickness, Bragg angle, asymmetry angle, and the speed of light. Applications to self-seeding of hard x-ray free electron lasers are discussed, with particular emphasis on the relative advantages of using either the Bragg or Laue scattering geometries. Intensity front inclination in asymmetric diffraction can be used to make snapshots of ultra-fast processes with femtosecond resolution

Laughlin-Jastrow-correlated Wigner crystal in a strong magnetic field

We propose a new ground state trial wavefunction for a two-dimensional Wigner crystal in a strong perpendicular magnetic field. The wavefunction includes Laughlin-Jastrow correlations between electron pairs, and may be interpreted as a crystal state of composite fermions or composite bosons. Treating the power $m$ of the Laughlin-Jastrow factor as a variational parameter, we use quantum Monte Carlo simulations to compute the energy of these new states. We find that our wavefunctions have lower energy than existing crystalline wavefunctions in the lowest Landau level. Our results are consistent with experimental observations of the filling factor at which the transition between the fractional quantum Hall liquid and the Wigner crystal occurs for electron systems. Exchange contributions to the wavefunctions are estimated quantitatively and shown to be negligible for sufficiently small filling factors

Electrophoresis of a rod macroion under polyelectrolyte salt: Is mobility reversed for DNA?

By molecular dynamics simulation, we study the charge inversion phenomenon of a rod macroion in the presence of polyelectrolyte counterions. We simulate electrophoresis of the macroion under an applied electric field. When both counterions and coions are polyelectrolytes, charge inversion occurs if the line charge density of the counterions is larger than that of the coions. For the macroion of surface charge density equal to that of the DNA, the reversed mobility is realized either with adsorption of the multivalent counterion polyelectrolyte or the combination of electrostatics and other mechanisms including the short-range attraction potential or the mechanical twining of polyelectrolyte around the rod axis.Comment: 8 pages, 5 figures, Applied Statistical Physics of Molecular Engineering (Mexico, 2003). Journal of Physics: Condensed Matters, in press (2004). Journal of Physics: Condensed Matters, in press (2004

Association between Participation in Outpatient Cardiac Rehabilitation and Self-Reported Receipt of Lifestyle Advice from a Healthcare Provider: Results of a Population-Based Cross-Sectional Survey

We test the hypothesis that the odds of self-reported receipt of lifestyle advice from a health care provider will be lower among outpatient cardiac rehabilitation (OCR) nonattendees and nonreferred patients compared to OCR attendees. Logistic regression was used to analyse cross-sectional data provided by 65% (4971/7678) of patients aged 20 to 84 years discharged from public hospitals with a diagnosis indicating eligibility for OCR between 2002 and 2007. Among respondents, 71% (3518) and 55% (2724) recalled advice regarding physical activity and diet, respectively, while 88% (592/674) of smokers recalled quit advice. OCR attendance was low: 36% (1764) of respondents reported attending OCR, 11% (552) did not attend following referral, and 45% (2217) did not recall being invited. The odds of recalling advice regarding physical activity and diet were significantly lower among OCR nonattendees compared to attendees (OR 0.34, 95% CI 0.21, 0.56 and OR 0.33, 95% CI 0.25, 0.44, resp.) and among nonreferred respondents compared to OCR attendees (OR 0.10, 95% CI 0.07, 0.15 and OR 0.17, 95% CI 0.14, 0.22, resp.). Patients hospitalised for coronary heart disease should be referred to OCR or a suitable alternative to improve recall of lifestyle advice that will reduce the risk of further coronary events