Current-induced exchange interactions and effective temperature in localized moment systems

We study theoretically the spin dynamics of a magnetic dimer serving as a contact between two electrodes. We find that the spin-spin coupling in the dimer can be dramatically modified from its equilibrium value. We show that the interaction can be tuned in such a way that it effectively changes its sign. The calculations show that, for large enough bias, the exchange interaction can even be changed from antiferromagnetic to ferromagnetic. The physical principles behind this result can be used as a new tool to achieve magneto-electric effects in molecular magnet systems.     

Theoretical vibrational terms and rotational constants for the 15N substituted isotopologues of N2O calculated using normal hyperspherical coordinates

Variational calculations of the vibrational terms G_v and rotational constants B_v of the ¹⁴N¹⁵N¹⁶O, ¹⁵N¹⁴N¹⁶O and ¹⁵N¹⁵N¹⁶O isotopologues of nitrous oxide are carried out using normal hyperspherical coordinates. The Morse-cosine potential energy surface for N₂O previously determined by the authors by fitting to a set of experimental vibrational frequencies is employed. The G_v and B_v spectroscopic constants calculated for the ¹⁵N substituted isotopologues show an satisfactory agreement with those experimentally observed for a large number of vibrational bands of these isotopologues recently measured. Predicted calculated values of these spectroscopic constants for unobserved vibrational bands of the ¹⁵N substituted isotopologues are given in order to be of help in the identification and characterization of such bands, as a complement to the use of global effective Hamiltonians.     

Cation distribution in natural ferrites

Mössbauer spectra of jacobsite have been recorded at temperatures of 4.2, 125, 180, 240 and 300 K and with an external magnetic field of 60 kOe applied parallel to the incident radiation at 4.2 K. The results show the presence of two different magnetic hyperfine interactions associated with the iron nuclei. Spectra of samples in external magnetic fields indicate the same sign for the magnetic hyperfine interactions, implying that both iron ions occupy only the octahedral sublattice. These results are compared with data from synthetic stoichiometry manganese ferrite, and a model of cation distribution, assuming the existence of vacancies, is proposed. According to this model, the mineral jacobsite is rich in manganese compared with stoichiometric MnFe₂O₄ ferrite.     

Generation of attosecond pulses in molecular nitrogen

We investigate the carrier-envelope phase dependence of the total ionization yield for single and double ionization of xenon. We compare our results to theoretical calculations and to the phase dependent asymmetry in photoelectron emission. We observe that the phase dependence of the photoion yields, regardless if single or double ionization, is at least 2-3 orders of magnitude below the photoelectron emission signal. We conclude that total photoionization yields are only very weakly dependent on the carrier envelope phase, and that they are not a useful means for measurement of the phase. It seems possible that the broad bandwidth of few-cycle pulses facilitates multiphoton ionization, which leads to a randomization of strong field ionization phase dependencies. Besides, we observe that the spatial asymmetry in photoelectron emission appears to be useful as an indicator for the laser pulse duration in the few cycle regime.     

On the Photophysical Properties of New Luminol Derivatives and their Synthetic Phthalimide Precursors

The photophysical properties of a series of structurally related 4-aminophthalimides and the corresponding 5-aminophthalic hydrazides (luminols) are reported. Absorption, steady-state, and time-resolved fluorescence spectra of luminols exhibited substitution, solvent, and pH dependence. Singlet lifetimes have been determined by time-resolved laser flash spectroscopy. UV spectra in gas phase and DMSO solution were calculated by TD-DFT which revealed the existence of two low-energy excited singlet states with strong pH-sensitivity.     

Sharp fronts in attracting-adatom monolayers

The problem of pattern formation by adsorbates undergoing attractive lateral interactions, is described by a parabolic integrodifferential equation having the scaled inverse temperature ? and the scaled pressure α of the vapor phase as parameters. A coexistence region of high- and low-coverage stable homogeneous states has been reported in the (?, α) plane. In the small interaction-range limit an effective diffusion coefficient can be defined, which becomes however negative for a coverage range in between the stable homogeneous ones. A novel free-energy-like Lyapunov functional is found here for this problem. When evaluated on the homogeneous states, it leads to a Maxwell-like construction which selects essentially the same value α(?) as the originally posited zero front-velocity condition. Moreover, its value on static fronts at this particular α(?) coincides with those of the homogeneous states. This article is dedicated to Prof. Helmut Brand with occasion of his 60th birthday.     

Superfluid density in a two-dimensional model of supersolid

We study in 2-dimensions the superfluid density of periodically modulated states in the framework of the mean-field Gross-Pitaevskiǐ model of a quantum solid. We obtain a full agreement for the superfluid fraction between a semi-theoretical approach and direct numerical simulations. As in 1-dimension, the superfluid density decreases exponentially with the amplitude of the particle interaction. We discuss the case when defects are present in this modulated structure. In the case of isolated defects (e.g. dislocations) the superfluid density only shows small changes. Finally, we report an increase of the superfluid fraction up to 50% in the case of extended macroscopical defects. We show also that this excess of superfluid fraction depends on the length of the complex network of grain boundaries in the system.     

Hydrogen adsorption on palladium and palladium hydride at 1 bar

The dissociative sticking probability for H₂ on Pd films supported on sputtered Highly Ordered Pyrolytic Graphite (HOPG) has been derived from measurements of the rate of the H–D exchange reaction at 1 bar. The sticking probability for H₂, S, is higher on Pd hydride than on Pd (a factor of 1.4 at 140 °C), but the apparent desorption energy derived from S is the same on Pd and Pd hydride within the uncertainty of the experiment. Density Functional Theory (DFT) calculations for the (1 1 1) surfaces of Pd and Pd hydride show that, at a surface H coverage of a full mono layer, H binds less strongly to Pd hydride than to Pd. The activation barrier for desorption at a H coverage of one mono layer is slightly lower on Pd hydride, whereas the activation energy for adsorption is similar on Pd and Pd hydride. It is concluded that the higher sticking probability on Pd hydride is most likely caused by a slightly lower equilibrium coverage of H, which is a consequence of the lower heat of adsorption for H on Pd hydride.     

Interaction of Candida parapsilosis isolates with human hair and nail surfaces revealed by scanning electron microscopy analysis

Candida parapsilosis is found frequently as commensal organism on epithelial tissues, and is also an increasing cause of nosocomial infection. Scanning electron microscope (SEM) observations were used to analyse the capability of C. parapsilosis cells to adhere and grow as biofilm on human natural substrates and to compare the adherence pattern of isolates exhibiting distinct phenotypes. Cells from the crepe phenotype are predominantly elongated and form pseudohyphae whereas cells from the smooth phenotype are yeast-shaped, either in liquid cultures or on human nail and hair surfaces. The electron micrographs revealed that C. parapsilosis cells from the smooth phenotype adhered in higher number to both surfaces compared to the observed for the crepe phenotype. SEM analysis of human hair surface revealed that cells from the smooth phenotype appear as clumped blastoconidia of uniform morphology embedded in a flocculent extracellular material forming biofilm. The extracellular material and biofilm were seeing in a less extension in the crepe phenotype. A distinct adherence pattern was observed when human nail was used as substrate. Here C. parapsilosis cells seem to be linked to surface structures of human nail plate. Fibrillar extracellular material was observed connecting neighbouring cells as well as nail surface.