Multiphoton free-free transitions in a spatially inhomogeneous laser field

Summary The results of an investigation are presented in which it is shown how the spatial inhomogeneity of a laser field modifies the multiphoton free-free transition cross-sections compared to the case of a homogeneous field. This kind of investigation is required to make more close contact with experiments in intense fields, as in these cases the inhomogeneity is produced by the focusing of the laser beam. Furthermore, taking into account the intensity spatial distribution allows us to achieve in an effective way the asymptotic decoupling of the scattered particles from the field, which is very important for theoretical models using asymptotic initial and final states embedded in the field. Differential and total cross-sections are calculated over a wide range of parameters as functions of the scattering angle, of the incoming-particle energy and of the laser intensity and frequency. The laser spatial inhomogeneity is found to wash out most of the oscillating behaviour of multiphoton differential cross-sections, derived within the model of a homogeneous laser. Little modifications are, instead, found in the total cross-sections which are simply scaled to slightly lower values. Crosssections with zero photon exchange are increased, while those with photon exchanges are lowered. This yields the result that the sum of all the ≪inhomogeneous≫ cross-sections is equal to the sum of all the ≪homogeneous≫ ones (sum rule). The multiphoton free-free transition differential cross-sections are found to be very sensitive quantities which may be used to get information on the laser properties and on their nonlinear behaviour, when these are not precisely known. To speed up publication, the authors of this paper have agreed to not receive the proofs for correction.     

Polymeric photoinitiators based on side-chain benzoin methyl ether and tertiary amine moieties for fast UV curable coatings

The synthesis is reported of a new series of polymeric photoinitiators obtained by copolymerization of a-methylolbenzoin methyl ether acrylate (MBA) with different N,N-dialkylamino alkyl acrylates. The copolymers have been fully characterized and employed in the photoinitiated polymerization and crosslinking reactions of a standard acrylic formulation for clear curable coatings. The photoinitiation activity of the above systems has been measured by using microwave dielectrometry and differential photocalorimetry, and compared with that found for the corresponding low-molecular-weight models. The results clearly indicate that the copolymeric systems display a remarkable decrease of the induction period and an improved overall activity in the UV curing of the acrylic coatings. An interpretation of the experimental findings is also reported.     

Aggregation tendency and reactivity toward AgX of cationic half-sandwich ruthenium(II) complexes bearing neutral N,O-ligands

The aggregation tendency of complexes [Ru(eta6-cymene)(N,O)Cl]X [N,O = 2-benzoylpyridine (2-bzpy), 1, and 2-acetylpyridine (2-acpy), 2, X- = BPh4- or PF6-] has been studied by means of PGSE NMR experiments. It was found that complexes with PF6- as counterion are mainly present in CD2Cl2 as ion pairs at low concentration, as a mixture of ion triples and free anions at medium concentration and as ion quadruples at elevated concentration. 19F, 1H-HOESY NMR experiments revealed that in ion triples and ion quadruples two cationic Ru-units pair up. Consistently, in the solid-state structure of 1PF6, determined through X-ray single-crystal investigation, two cationic Ru-units are held together by an intermolecular pi-pi stacking interaction between the pyridyl rings. Complexes having BPh4- as counterion are only present in solution as even aggregates, namely ion pairs at low concentration and ion quadruples at elevated concentration. In such a case a counteranion bridges two cationic Ru-units as observed in the solid-state structure of 1BPh4. The reactivity of complexes 1-2 toward AgX salts has been investigated in different solvents. Bicationic [Ru(eta6-cymene)(N,O)(MeCN)]X2 (N,O = 2-bzpy, 3, and 2-acpy, 4) and [Ru(MeCN)4(N,O)]X2 (N,O = 2-bzpy, 5, and 2-acpy, 6) complexes were obtained by the reaction of 1 and 2 with AgX in the presence of three equivalents of acetonitrile or in acetonitrile, respectively. The reaction of 1 with AgPF6 in acetone afforded complex [Ru(eta6-cymene)(N,O,O)]PF6 (7, where N,O,O = 4-alcoxide-4-phenyl-4-(pyridin-2-yl)butan-2-one) from the C-C coupling of a deprotonated methyl group of the coordinated acetone and the C=O moiety of 2-bzpy ligand.     

A TDDFT study of the excited states of DNA bases and their assemblies

We present a detailed study of the optical absorption spectra of DNA bases and base pairs, carried out by means of time dependent density functional theory. The spectra for the isolated bases are compared to available theoretical and experimental data and used to assess the accuracy of the method and the quality of the exchange-correlation functional. Our approach turns out to be a reliable tool to describe the response of the nucleobases. Furthermore, we analyze in detail the impact of hydrogen bonding and pi-stacking in the calculated spectra for both Watson-Crick base pairs and Watson-Crick stacked assemblies. We show that the reduction of the UV absorption intensity (hypochromicity) for light polarized along the base-pair plane depends strongly on the type of interaction. For light polarized perpendicular to the basal plane, the hypochromicity effect is reduced, but another characteristic is found, namely a blue shift of the optical spectrum of the base-assembly compared to that of the isolated bases. The use of optical tools as fingerprints for the characterization of the structure (and type of interaction) is extensively discussed.     

Raman spectroscopic characterization of a thiophene‐based active material for resistive organic nonvolatile memories

A combined theoretical and experimental Raman study is presented on a diphenyl bithiophene molecule known as a good candidate for the development of organic nonvolatile memory devices. Spectroscopic markers suitable to distinguish the different stable conformers of the molecule have been predicted and detected. The combined analysis of theoretical and experimental Raman spectra recorded in solution indicates that at room temperature a dynamical equilibrium, characterized by interconversion between the two more stable conformers (namely trans and cis), takes place and that the more populated species is the cis form. Referring to the solid phase instead, Raman spectra of single‐crystal samples show the presence of the only trans conformer, as confirmed by X‐ray measurements. Finally, Raman spectra of thin films, as those used for the memory device, were collected; samples just deposited from solution and after few hours from the deposition were analyzed. Following the evolution of selective spectroscopic Raman markers, an isomerization process from the abundant cis (as‐deposited) to the totally trans (after few hours) conformer in the solid phase was detected. These results open the way to the identification of the molecular isomers present in the thin film of the memory cell and finally of the active molecular species involved in the switching mechanism of the operating device. Copyright © 2009 John Wiley & Sons, Ltd.     

The a.c. susceptibility third harmonic component of NdO1−0.14F0.14FeAs: A flux dynamic magnetic analysis

In this contribution we present the analysis of the third harmonic susceptibility data of the new superconductor NdFeAs_1−0.14F_0.14. ‘Cole-Cole’ polar plots respect to the magnetic frequency of the exciting field are presented and discussed. Data show that NdFeAs_1−0.14F_0.14 exhibit a ‘bulk pinning’ with a 3D flux dynamic character. A comparison of the responses of high T_c materials and an evaluation of theoretical critical states is also presented.     

Group field theory with noncommutative metric variables

We introduce a dual formulation of group field theories as a type of noncommutative field theories, making their simplicial geometry manifest. For Ooguri-type models, the Feynman amplitudes are simplicial path integrals for BF theories. We give a new definition of the Barrett-Crane model for gravity by imposing the simplicity constraints directly at the level of the group field theory action.     

John and Uniform Domains in Generalized Siegel Boundaries

Potential Analysis - Given the pair of vector fields X = ?x + |z|2my?t and Y = ?y ?|z|2mx?t,where (x,y,t) = , we give a condition on a bounded domain which ensures...