711 resultados para DIPOLE


Relevância:

10.00% 10.00%

Publicador:

Resumo:

El diseño de una antena reflectarray bajo la aproximación de periodicidad local requiere la determinación de la matriz de scattering de estructuras multicapa con metalizaciones periódicas para un gran número de geometrías diferentes. Por lo tanto, a la hora de diseñar antenas reflectarray en tiempos de CPU razonables, se necesitan herramientas númericas rápidas y precisas para el análisis de las estructuras periódicas multicapa. En esta tesis se aplica la versión Galerkin del Método de los Momentos (MDM) en el dominio espectral al análisis de las estructuras periódicas multicapa necesarias para el diseño de antenas reflectarray basadas en parches apilados o en dipolos paralelos coplanares. Desgraciadamente, la aplicación de este método numérico involucra el cálculo de series dobles infinitas, y mientras que algunas series convergen muy rápidamente, otras lo hacen muy lentamente. Para aliviar este problema, en esta tesis se propone un novedoso MDM espectral-espacial para el análisis de las estructuras periódicas multicapa, en el cual las series rápidamente convergente se calculan en el dominio espectral, y las series lentamente convergentes se calculan en el dominio espacial mediante una versión mejorada de la formulación de ecuaciones integrales de potenciales mixtos (EIPM) del MDM. Esta versión mejorada se basa en la interpolación eficiente de las funciones de Green multicapa periódicas, y en el cálculo eficiente de las integrales singulares que conducen a los elementos de la matriz del MDM. El novedoso método híbrido espectral-espacial y el tradicional MDM en el dominio espectral se han comparado en el caso de los elementos reflectarray basado en parches apilados. Las simulaciones numéricas han demostrado que el tiempo de CPU requerido por el MDM híbrido es alrededor de unas 60 veces más rápido que el requerido por el tradicional MDM en el dominio espectral para una precisión de dos cifras significativas. El uso combinado de elementos reflectarray con parches apilados y técnicas de optimización de banda ancha ha hecho posible diseñar antenas reflectarray de transmisiónrecepción (Tx-Rx) y polarización dual para aplicaciones de espacio con requisitos muy restrictivos. Desgraciadamente, el nivel de aislamiento entre las polarizaciones ortogonales en antenas DBS (típicamente 30 dB) es demasiado exigente para ser conseguido con las antenas basadas en parches apilados. Además, el uso de elementos reflectarray con parches apilados conlleva procesos de fabricación complejos y costosos. En esta tesis se investigan varias configuraciones de elementos reflectarray basadas en conjuntos de dipolos paralelos con el fin de superar los inconvenientes que presenta el elemento basado en parches apilados. Primeramente, se propone un elemento consistente en dos conjuntos apilados ortogonales de tres dipolos paralelos para aplicaciones de polarización dual. Se ha diseñado, fabricado y medido una antena basada en este elemento, y los resultados obtenidos para la antena indican que tiene unas altas prestaciones en términos de ancho de banda, pérdidas, eficiencia y discriminación contrapolar, además de requerir un proceso de fabricación mucho más sencillo que el de las antenas basadas en tres parches apilados. Desgraciadamente, el elemento basado en dos conjuntos ortogonales de tres dipolos paralelos no proporciona suficientes grados de libertad para diseñar antenas reflectarray de transmisión-recepción (Tx-Rx) de polarización dual para aplicaciones de espacio por medio de técnicas de optimización de banda ancha. Por este motivo, en la tesis se propone un nuevo elemento reflectarray que proporciona los grados de libertad suficientes para cada polarización. El nuevo elemento consiste en dos conjuntos ortogonales de cuatro dipolos paralelos. Cada conjunto contiene tres dipolos coplanares y un dipolo apilado. Para poder acomodar los dos conjuntos de dipolos en una sola celda de la antena reflectarray, el conjunto de dipolos de una polarización está desplazado medio período con respecto al conjunto de dipolos de la otra polarización. Este hecho permite usar solamente dos niveles de metalización para cada elemento de la antena, lo cual simplifica el proceso de fabricación como en el caso del elemento basados en dos conjuntos de tres dipolos paralelos coplanares. Una antena de doble polarización y doble banda (Tx-Rx) basada en el nuevo elemento ha sido diseñada, fabricada y medida. La antena muestra muy buenas presentaciones en las dos bandas de frecuencia con muy bajos niveles de polarización cruzada. Simulaciones numéricas presentadas en la tesis muestran que estos bajos de niveles de polarización cruzada se pueden reducir todavía más si se llevan a cabo pequeñas rotaciones de los dos conjuntos de dipolos asociados a cada polarización. ABSTRACT The design of a reflectarray antenna under the local periodicity assumption requires the determination of the scattering matrix of a multilayered structure with periodic metallizations for quite a large number of different geometries. Therefore, in order to design reflectarray antennas within reasonable CPU times, fast and accurate numerical tools for the analysis of the periodic multilayered structures are required. In this thesis the Galerkin’s version of the Method of Moments (MoM) in the spectral domain is applied to the analysis of the periodic multilayered structures involved in the design of reflectarray antennas made of either stacked patches or coplanar parallel dipoles. Unfortunately, this numerical approach involves the computation of double infinite summations, and whereas some of these summations converge very fast, some others converge very slowly. In order to alleviate this problem, in the thesis a novel hybrid MoM spectral-spatial domain approach is proposed for the analysis of the periodic multilayered structures. In the novel approach, whereas the fast convergent summations are computed in the spectral domain, the slowly convergent summations are computed by means of an enhanced Mixed Potential Integral Equation (MPIE) formulation of the MoM in the spatial domain. This enhanced formulation is based on the efficient interpolation of the multilayered periodic Green’s functions, and on the efficient computation of the singular integrals leading to the MoM matrix entries. The novel hybrid spectral-spatial MoM code and the standard spectral domain MoM code have both been compared in the case of reflectarray elements based on multilayered stacked patches. Numerical simulations have shown that the CPU time required by the hybrid MoM is around 60 times smaller than that required by the standard spectral MoM for an accuracy of two significant figures. The combined use of reflectarray elements based on stacked patches and wideband optimization techniques has made it possible to design dual polarization transmit-receive (Tx-Rx) reflectarrays for space applications with stringent requirements. Unfortunately, the required level of isolation between orthogonal polarizations in DBS antennas (typically 30 dB) is hard to achieve with the configuration of stacked patches. Moreover, the use of reflectarrays based on stacked patches leads to a complex and expensive manufacturing process. In this thesis, we investigate several configurations of reflectarray elements based on sets of parallel dipoles that try to overcome the drawbacks introduced by the element based on stacked patches. First, an element based on two stacked orthogonal sets of three coplanar parallel dipoles is proposed for dual polarization applications. An antenna made of this element has been designed, manufactured and measured, and the results obtained show that the antenna presents a high performance in terms of bandwidth, losses, efficiency and cross-polarization discrimination, while the manufacturing process is cheaper and simpler than that of the antennas made of stacked patches. Unfortunately, the element based on two sets of three coplanar parallel dipoles does not provide enough degrees of freedom to design dual-polarization transmit-receive (Tx-Rx) reflectarray antennas for space applications by means of wideband optimization techniques. For this reason, in the thesis a new reflectarray element is proposed which does provide enough degrees of freedom for each polarization. This new element consists of two orthogonal sets of four parallel dipoles, each set containing three coplanar dipoles and one stacked dipole. In order to accommodate the two sets of dipoles in each reflectarray cell, the set of dipoles for one polarization is shifted half a period from the set of dipoles for the other polarization. This also makes it possible to use only two levels of metallization for the reflectarray element, which simplifies the manufacturing process as in the case of the reflectarray element based on two sets of three parallel dipoles. A dual polarization dual-band (Tx-Rx) reflectarray antenna based on the new element has been designed, manufactured and measured. The antenna shows a very good performance in both Tx and Rx frequency bands with very low levels of cross-polarization. Numerical simulations carried out in the thesis have shown that the low levels of cross-polarization can be even made smaller by means of small rotations of the two sets of dipoles associated to each polarization.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

Averaged event-related potential (ERP) data recorded from the human scalp reveal electroencephalographic (EEG) activity that is reliably time-locked and phase-locked to experimental events. We report here the application of a method based on information theory that decomposes one or more ERPs recorded at multiple scalp sensors into a sum of components with fixed scalp distributions and sparsely activated, maximally independent time courses. Independent component analysis (ICA) decomposes ERP data into a number of components equal to the number of sensors. The derived components have distinct but not necessarily orthogonal scalp projections. Unlike dipole-fitting methods, the algorithm does not model the locations of their generators in the head. Unlike methods that remove second-order correlations, such as principal component analysis (PCA), ICA also minimizes higher-order dependencies. Applied to detected—and undetected—target ERPs from an auditory vigilance experiment, the algorithm derived ten components that decomposed each of the major response peaks into one or more ICA components with relatively simple scalp distributions. Three of these components were active only when the subject detected the targets, three other components only when the target went undetected, and one in both cases. Three additional components accounted for the steady-state brain response to a 39-Hz background click train. Major features of the decomposition proved robust across sessions and changes in sensor number and placement. This method of ERP analysis can be used to compare responses from multiple stimuli, task conditions, and subject states.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

Fast transverse relaxation of 1H, 15N, and 13C by dipole-dipole coupling (DD) and chemical shift anisotropy (CSA) modulated by rotational molecular motions has a dominant impact on the size limit for biomacromolecular structures that can be studied by NMR spectroscopy in solution. Transverse relaxation-optimized spectroscopy (TROSY) is an approach for suppression of transverse relaxation in multidimensional NMR experiments, which is based on constructive use of interference between DD coupling and CSA. For example, a TROSY-type two-dimensional 1H,15N-correlation experiment with a uniformly 15N-labeled protein in a DNA complex of molecular mass 17 kDa at a 1H frequency of 750 MHz showed that 15N relaxation during 15N chemical shift evolution and 1HN relaxation during signal acquisition both are significantly reduced by mutual compensation of the DD and CSA interactions. The reduction of the linewidths when compared with a conventional two-dimensional 1H,15N-correlation experiment was 60% and 40%, respectively, and the residual linewidths were 5 Hz for 15N and 15 Hz for 1HN at 4°C. Because the ratio of the DD and CSA relaxation rates is nearly independent of the molecular size, a similar percentagewise reduction of the overall transverse relaxation rates is expected for larger proteins. For a 15N-labeled protein of 150 kDa at 750 MHz and 20°C one predicts residual linewidths of 10 Hz for 15N and 45 Hz for 1HN, and for the corresponding uniformly 15N,2H-labeled protein the residual linewidths are predicted to be smaller than 5 Hz and 15 Hz, respectively. The TROSY principle should benefit a variety of multidimensional solution NMR experiments, especially with future use of yet somewhat higher polarizing magnetic fields than are presently available, and thus largely eliminate one of the key factors that limit work with larger molecules.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

N-Methyl-D-aspartate (NMDA) receptors are blocked at hyperpolarizing potentials by extracellular Mg ions. Here we present a detailed kinetic analysis of the Mg block in recombinant wild-type and mutant NMDA receptors. We find that the Mg binding site is the same in the wild-type and native hippocampal NMDA receptor channels. In the mutant channels, however, Mg ions bind with a 10-fold lower affinity. On the basis of these results, we propose that the energy well at the Mg binding site in the mutants is shallow and the binding is unstable because of an increase in the rate of dissociation. We postulate that the dipole formed by the amide group of asparagine 614 of the epsilon 1 subunit contributes to the structure of the binding site but predict that additional ligands will be involved in coordinating Mg ions.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

A simple model is described for calculating the electrostatic energy of lipid domains at the air-water interface, taking account of dipole-dipole repulsions between the lipid molecules themselves, as well as interactions between the molecular dipoles and image dipoles in the subphase. The model assumes that the molecular dipoles within the monolayer arise from the terminal methyl groups of the hydrophobic hydrocarbon chains of the lipid molecules, and that on average they are oriented perpendicular to the plane of the monolayer. With this model the role of the subphase is to enhance rather than suppress the effects of dipole-dipole repulsions.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

A Espectroscopia Raman Intensificada pela Superfície (SERS) é um efeito de intensificação da intensidade Raman de uma molécula adsorvida numa superfície metálica nanoestruturada. Esta característica permite a utilização do SERS na caracterização vibracional de sistemas como junções moleculares (JM) (JM são sistemas constituídos de fios moleculares sintetizados em junções do tipo metal|fiomolecular|metal) e, no entendimento de quais características morfológicas de agregados metálicos mais influenciariam no sinal SERS obtido. Portanto, esta tese apresenta os seguintes objetivos: (a) síntese e caracterização de substratos SERS ativos, nanoesferas (AuNE) e nanobastões (AuNB) de ouro e eletrodo de ouro ativado eletroquimicamente; (b) síntese e caracterização SERS de fios moleculares em JM; (c) estudo do acoplamento plasmônico entre as superfícies metálicas em JM; (d) correlação entre SERS - morfologia de agregados individuais de AuNB. Os fios moleculares estudados foram os da família das oligofeniliminas (OPI) e, no melhor do nosso entendimento, esta foi a primeira vez que fios moleculares desta família foram caracterizados por Raman e SERS. As JM apresentaram um comportamento SERS não esperado. Enquanto para o modo vibracional, v(CS), a intensidade da banda se apresentou constante com o aumento do espaçamento entre as nanoestruturas metálicas (para distâncias de até 5 nm), o modo vibracional, β(CH), teve a intensidade de sua banda aumentada. Este comportamento foi explicado considerando a diferente natureza da interação dos plasmons nas JM, sendo estas interações do tipo, ressonância de plasmon de superfície (LSPR) - dipolo imagem, para ambos os modos. No entanto, para o modo β(CH) existe também uma intensificação extra devido ao aumento da polarizabilidade dos fios moleculares com o aumento do número de unidades. A correlação SERS - morfologia dos agregados de AuNB indicam que, para agregados onde predominam interações ponta a ponta, os espectros SERS apresentavam uma maior intensidade quando comparados com aqueles em que interações lado a lado predominavam. No entanto, este comportamento não foi observado para agregados contendo mais do que cinco nanopartículas onde estes dois tipos de interações ocorrem indicando que deve existir um acoplamento dos plasmons destes dois tipos de interações contribuindo para maiores valores de intensidade SERS.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

1,3,5-tricarboxamida-ciclo-hexano são compostos capazes de se autoagregarem formando colunas supramoleculares as quais se mantêm unidas não só devido às interações das cadeias laterais mas também devido às ligações de hidrogênio de cada um dos três grupos amida por monômero. Cada monômero possui momento de dipolo elétrico associado aos grupos amida. Quando as amidas dos vários monômeros dentro da mesma coluna estão apontadas para a mesma direção, os momentos de dipolo individuais de todas as amidas se somam formando elevado dipolo ao longo do eixo da coluna, chamado de macrodipolo, o qual influencia as interações intercolunares. Neste trabalho foram investigadas quatro conformações as quais diferem entre si em relação à orientação dos grupos carbonila: a conformação Up-Up contém grupos carbonilas paralelos dentro das colunas e colunas paralela, a conformação Up-Down possui grupos carbonilas paralelos dentro das colunas e colunas antiparalelas, a conformação Intra-Up-Up contém grupos carbonilas antiparalelos dentro das colunas e colunas paralelas e a conformação Intra-Up-Down possui grupos carbonilas antiparalelos dentro das colunas e colunas antiparalelas. Foi usado Dinâmica Molecular Clássica para investigar o efeito das interações macrodipolo-macrodipolo das quatro diferentes conformações sobre a estabilidade térmica de três diferentes compostos derivados de 1,3,5-tricarboxamida-ciclo-hexano. Foi verificado que as conformações com colunas antiparalelas tendem a ser ligeiramente mais estáveis do que as conformações com orientação paralela. O efeito da orientação dos grupos carbonila dentro das colunas sob a estabilidade do material está relacionado a vários fatores, tais como cargas atômicas parciais, arranjo colunar ou natureza das cadeias laterais, e os resultados não são tão diretos como quando se compara as orientações entre colunas. Outro tópico investigado foi o comportamento do material durante a transição da fase colunar para a fase desordenada. As colunas podem se desmontar em três diferentes formas: elas podem completamente se desintegrar rapidamente, podem primeiro se desintegrar lentamente e então perder a ordem colunar ou primeiro perdem a ordem colunar e então se desmontam em um processo demorado. Tais comportamentos estão associados com as interações dentro e entre colunas.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

In this thesis, we present the generation and studies of a 87Rb Bose-Einstein condensate (BEC) perturbed by an oscillatory excitation. The atoms are trapped in a harmonic magnetic trap where, after an evaporative cooling process, we produce the BEC. In order to study the effect caused by oscillatory excitations, a quadrupole magnetic field time oscillatory is superimposed to the trapping potential. Through this perturbation, collective modes were observed. The dipole mode is excited even for low excitation amplitudes. However, a minimum excitation energy is needed to excite the condensate quadrupole mode. Observing the excited cloud in TOF expansion, we note that for excitation amplitude in which the quadrupole mode is excited, the cloud expands without invert its aspect ratio. By looking these clouds, after long time-of-flight, it was possible to see vortices and, sometimes, a turbulent state in the condensed cloud. We calculated the momentum distribution of the perturbed BECs and a power law behavior, like the law to Kolmogorov turbulence, was observed. Furthermore, we show that using the method that we have developed to calculate the momentum distribution, the distribution curve (including the power law exponent) exhibits a dependence on the quadrupole mode oscillation of the cloud. The randomness distribution of peaks and depletions in density distribution image of an expanded turbulent BEC, remind us to the intensity profile of a speckle light beam. The analogy between matter-wave speckle and light speckle is justified by showing the similarities in the spatial propagation (or time expansion) of the waves. In addition, the second order correlation function is evaluated and the same dependence with distance was observed for the both waves. This creates the possibility to understand the properties of quantum matter in a disordered state. The propagation of a three-dimensional speckle field (as the matter-wave speckle described here) creates an opportunity to investigate the speckle phenomenon existing in dimensions higher than 2D (the case of light speckle).

Relevância:

10.00% 10.00%

Publicador:

Resumo:

Time-variable gravity data from the Gravity Recovery And Climate Experiment (GRACE) mission are used to study total water content over Australia for the period 2002–2010. A time-varying annual signal explains 61% of the variance of the data, in good agreement with two independent estimates of the same quantity from hydrological models. Water mass content variations across Australia are linked to Pacific and Indian Ocean variability, associated with El Niño-Southern Oscillation (ENSO) and the Indian Ocean Dipole (IOD), respectively. From 1989, positive (negative) IOD phases were related to anomalously low (high) precipitation in southeastern Australia, associated with a reduced (enhanced) tropical moisture flux. In particular, the sustained water mass content reduction over central and southern regions of Australia during the period 2006–2008 is associated with three consecutive positive IOD events.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

The 1,3-dipolar cycloaddition between azomethine ylides and alkenes is efficiently catalysed by [{(Sa)-Binap-Au(tfa)}2] (Binap=2,2′-bis(diphenylphosphino)-1,1′-binaphthyl; tfa=trifluoroacetyl). Maleimides, 1,2-bis(phenylsulfonyl)ethylene, chalcone and nitrostyrene were suitable dipolarophiles even when using sterically hindered 1,3-dipole precursors. The results obtained in these transformations improve the analogous ones obtained in the same reactions catalysed by [Binap–Ag(tfa)]. In addition, computational studies have also been carried out to demonstrate both the high enantioselectivity exhibited by the chiral gold(I) complex, and the non-linear effect observed in this transformation.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

Kinetics of 1,3-dipolar cycloaddition involving azomethine ylides, generated from thermal [1,2]-prototropy of the corresponding imino ester, employing differential scanning calorimetry (DSC), is surveyed. Glycine and phenylalanine derived imino esters have different behavior. The first one prefers reacting with itself at 75 ºC, rather than with the dipolarophile. However, the α-substituted imino ester gives the cycloadduct at higher temperatures. The thermal dynamic analysis by 1H NMR of the neat reaction mixture of the glycine derivative reveals the presence of signals corresponding to the dipole in very small proportion. The non-isothermal and isothermal DSC curves of the cycloaddition of phenylalaninate and diisobutyl fumarate are obtained from freshly prepared samples. The application of known kinetic models and mathematical multiple non-linear regressions (NLR) allow to determine and to compare Ea, lnA, reaction orders, and reaction enthalpy. Finally a rate equation for each different temperature can be established for this particular thermal cycloaddition.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

The thermal multicomponent 1,3-dipolar cycloaddition (1,3-DC) of diethyl aminomalonate or α-amino esters (derived from glycine, alanine, phenylalanine, and phenylglycine) with ethyl glyoxylate and the corresponding dipolarophile such as maleimides, methyl acrylate, methyl fumarate, (E)-1,2-bis(phenylsulfonyl)ethylene, and electron deficient alkynes allows the diastereoselective synthesis of new polysubstituted pyrrolidine derivatives. Microwave-assisted heating processes give better results than conventional heating ones, affording endo-cycloadducts as major stereoisomers. In general, 2,5-cis-cycloadducts are preferentially formed according to the previous formation of the W-shaped dipole. Only in the 1,3-DC of the disulfone with phenylglycine and ethyl glyoxylate the corresponding exo-trans-cycloadduct was isolated. The compound endo-cis-4b, derived from phenylalanine, ethyl glyoxylate and N-benzylmaleimide, has been further transformed into a very complex diazabicyclo[2.2.1]octane skeleton with potential biological activity.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

SGR 0418+5729 is a transient soft gamma-ray repeater which underwent a major outburst in 2009 June, during which the emission of short bursts was observed. Its properties appeared quite typical of other sources of the same class until long-term X-ray monitoring failed to detect any period derivative. The present upper limit on P implies that the surface dipole field is Bp lsim 7.5 × 1012 G, well below those measured in other soft gamma-ray repeaters (SGRs) and in the Anomalous X-ray Pulsars (AXPs), a group of similar sources. Both SGRs and AXPs are currently believed to be powered by ultra-magnetized neutron stars (magnetars, Bp ≈ 1014-1015 G). SGR 0418+5729 hardly seems to fit in such a picture. We show that the magneto-rotational properties of SGR 0418+5729 can be reproduced if this is an aged magnetar, ≈1 Myr old, which experienced substantial field decay. The large initial toroidal component of the internal field required to match the observed properties of SGR 0418+5729 ensures that crustal fractures, and hence bursting activity, can still occur at the present time. The thermal spectrum observed during the outburst decay is compatible with the predictions of a resonant Compton scattering model (as in other SGRs/AXPs) if the field is low and the magnetospheric twist is moderate.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

We have measured experimental adsorption isotherms of water in zeolite LTA4A, and studied the regeneration process by performing subsequent adsorption cycles after degassing at different temperatures. We observed incomplete desorption at low temperatures, and cation rearrangement at successive adsorption cycles. We also developed a new molecular simulation force field able to reproduce experimental adsorption isotherms in the range of temperatures between 273 K and 374 K. Small deviations observed at high pressures are attributed to the change in the water dipole moment at high loadings. The force field correctly describes the preferential adsorption sites of water at different pressures. We tested the influence of the zeolite structure, framework flexibility, and cation mobility when considering adsorption and diffusion of water. Finally, we performed checks on force field transferability between different hydrophilic zeolite types, concluding that classical, non-polarizable water force fields are not transferable.

Relevância:

10.00% 10.00%

Publicador:

Resumo:

Magnetars are neutron stars in which a strong magnetic field is the main energy source. About two dozens of magnetars, plus several candidates, are currently known in our Galaxy and in the Magellanic Clouds. They appear as highly variable X-ray sources and, in some cases, also as radio and/or optical pulsars. Their spin periods (2–12 s) and spin-down rates (∼10−13–10−10 s s−1) indicate external dipole fields of ∼1013−15 G, and there is evidence that even stronger magnetic fields are present inside the star and in non-dipolar magnetospheric components. Here we review the observed properties of the persistent emission from magnetars, discuss the main models proposed to explain the origin of their magnetic field and present recent developments in the study of their evolution and connection with other classes of neutron stars.