Pour les systèmes de commande sous la forme de dx/dt = f (x, u), dans la littérature, les chercheurs s'intéressaient à la stabilisation de ce système de différentes manières : asymptotique, uniformément asymptotique, partielle, en temps fini, etc. Pour aboutir à ces résultats, les méthodes utilisées font appel aux techniques suivantes : Lyapunov, Lasalle, Barbalat, surface glissante, etc. Dans cette thèse, nous nous sommes intéressés à une autre fonctionnalité de la commande, dite commande répulsive stabilisante. Les résultats ont été généralisés au cas d'un système avec dérive et sans dérive. Comme résultat, l'approche de commande qu'on propose assure la stabilité du système autour d'une position désirée et la répulsion de celui-ci par rapport à un ensemble indésirable, construit dans l'espace de navigation. Toute forme d'application sera concernée par nos résultats théoriques, on peut citer, la navigation terrestre et aérienne dans un environnement peu ou pas connu. De même, la commande qu'on propose préserve la communication inter-agent, une fois planifiées. En terme d'application, on a considéré le modèle d'un véhicule à roues type unicycle, sans tenir compte de l'orientation (cas non holonôme) et dans le cas où l'environnement contient un ou plusieurs obstacle(s). Contrairement aux résultats de la littérature, qui sont basés sur une commande à structure variable pour l'évitement d'un obstacle, la commande répulsive-stabilisante trouvée est une commande continue sur l'espace de navigation. La deuxième partie de cette thèse traite le problème de stabilité d'une formation d'agents (système multi-véhicules) qui évolue dans un environnement hostile tout en préservant la communication entre les agents. Pour réussir la formation, la décentralisation de la commande par rapport aux agents est rendue robuste à travers des graphes de communication. Ces graphes relèvent de la stratégie et objectifs de la formation. Nos résultats de stabilité ont fait l'objet d'une implémentation rigoureuse sur un simulateur réalisé sous Matlab.

An extension of the nonadiabatic quantum molecular dynamics approach is presented to account for electron-nuclear correlations in the dynamics of atomic many-body systems. The method combines electron dynamics described within time-dependent density-functional or Hartree-Fock theory with trajectory-surface-hopping dynamics for the nuclei, allowing us to take into account explicitly a possible external laser field. As a case study, a model system of H++H collisions is considered where full quantum-mechanical calculations are available for comparison. For this benchmark system the extended surface-hopping scheme exactly reproduces the full quantum results. Future applications are briefly outlined.

This thesis presents the results of a comparison between collision data and simulations based on Monte Carlo methods. The experimental dataset consists of $20.3\,\mathrm{fb}^{-1}$ of proton-proton collision data at $\sqrt s = 8\tev$ collected during 2012 by the ATLAS experiment located at the Large Hadron Collider. The final state used is $e\mu + \mathrm{jets}$. Four regions are defined, pretag ($\geq0$ jets, $\geq0$ $b$-jets), $\geq1$-tag ($\geq1$ jets, $\geq1$ $b$-jets), $\geq2$-jet ($\geq2$ jets, $\geq0$ $b$-jets), and 2-tag ($\geq2$ jets, 2 $b$-jets). Data and simulations are consistent in all regions considered.

In this thesis, CMs of linear and non-linear multiple antenna receivers, in particular linear minimum mean squared error (LMMSE) and LMMSE with decision feedback (LMMSE-DF), are developed. To develop these CMs, first a simple analytical expression of the distribution of the post processing signal to interference and noise (SINR) of an LMMSE receiver is developed. This expression is then used to develop SINR- and ABER-based CMs. However, the analytical forms of these CMs are derived only for the following scenarios: (i) any number of receive antennas with three users having arbitrary received powers and (ii) two antenna receiver with arbitrary number of equal received power users. For all the other scenarios a semi-analytical CM is used. The PHY abstractions or CMs are next used in the evaluation of a random access cellular network and an ad hoc network. Analytical model of the random access cellular network is developed using the SINR- and ABER-based CM of the LMMSE receiver. The impact of receiver processing is measured in terms of throughput. In this case, the random access mechanism is modeled by a single channel S-Aloha channel access scheme. Another analytical model is developed for single and multi-packet reception in a multi-channel S-Aloha channel access. An emph{ideal} receiver is modeled in this case, i.e. the packet(s) are successfully received as long as the total number of colliding packets is not greater than the number of antennas. Throughput and delay are used as performance metrics to study the impact of different PHY designs. Finally, the SINR-based semi-analytical CMs of LMMSE and LMMSE-DF are used to evaluate the performance of multi-hop ad hoc networks. Throughput is used as the performance evaluation metric. A novel MAC, called S-MAC, is proposed and its performance is compared against another MAC for wireless networks, called CSMA/CA(k).

In the last decade, ultracold plasmas have been created in the laboratory by photo-ionizing laser-cooled atoms. To understand the overall dynamics of ultracold plasmas, one needs to understand Rydberg collisional processes at ultracold temperatures. The two kinds of problems addressed in this thesis are: study of Rydberg atomic processes at ultracold temperatures, and a study of the overall dynamics of the ultracold plasmas. Theoretical methods based on quantal-classical correspondence is used to understand Rydberg atomic processes such as radiative cascade, and radiative recombination. A simulation method suitable for ultracold collisions is developed and tested. This method is then applied to study collisional-Stark mixing in Rydberg atoms. To study the dynamics of the ultracold plasmas, a King model for the electrons in plasmas is proposed. The King model is a stationary, finite sized electron distribution for the electrons in a cloud of fixed ions with a Gaussian distribution. A Monte-Carlo method is developed to simulate the overall dynamics of the King distribution.

Drastic changes in aircraft operational requirements and the emergence of new enabling technologies often occur symbiotically with advances in technology inducing new requirements and vice versa. These changes sometimes lead to the design of vehicle concepts for which no prior art exists. They lead to revolutionary concepts. In such cases the basic form of the vehicle geometry can no longer be determined through an ex ante survey of prior art as depicted by aircraft concepts in the historical domain. Ideally, baseline geometries for revolutionary concepts would be the result of exhaustive configuration space exploration and optimization. Numerous component layouts and their implications for the minimum external dimensions of the resultant vehicle would be evaluated. The dimensions of the minimum enclosing envelope for the best component layout(s) (as per the design need) would then be used as a basis for the selection of a baseline geometry. Unfortunately layout design spaces are inherently large and the key contributing analysis i.e. collision detection, can be very expensive as well. Even when an appropriate baseline geometry has been identified, another hurdle i.e. vehicle scaling has to be overcome. Through the design of a notional Cessna C-172R powered by a liquid hydrogen Proton Exchange Membrane (PEM) fuel cell, it has been demonstrated that the various forms of vehicle scaling i.e. photographic and historical-data-based scaling can result in highly sub-optimal results even for very small O(10-3) scale factors. There is therefore a need for higher fidelity vehicle scaling laws especially since emergent technologies tend to be volumetrically and/or gravimetrically constrained when compared to incumbents. The Configuration-space Exploration and Scaling Methodology (CESM) is postulated herein as a solution to the above-mentioned challenges. This bottom-up methodology entails the representation of component or sub-system geometries as matrices of points in 3D space. These typically large matrices are reduced using minimal convex sets or convex hulls. This reduction leads to significant gains in collision detection speed at minimal approximation expense. (The Gilbert-Johnson-Keerthi algorithm is used for collision detection purposes in this methodology.) Once the components are laid out, their collective convex hull (from here on out referred to as the super-hull) is used to approximate the inner mold line of the minimum enclosing envelope of the vehicle concept. A sectional slicing algorithm is used to extract the sectional dimensions of this envelope. An offset is added to these dimensions in order to come up with the sectional fuselage dimensions. Once the lift and control surfaces are added, vehicle level objective functions can be evaluated and compared to other designs. For each design, changes in the super-hull dimensions in response to perturbations in requirements can be tracked and regressed to create custom geometric scaling laws. The regressions are based on dimensionally consistent parameter groups in order to come up with dimensionally consistent and thus physically meaningful laws. CESM enables the designer to maintain design freedom by portably carrying multiple designs deeper into the design process. Also since CESM is a bottom-up approach, all proposed baseline concepts are implicitly volumetrically feasible. Furthermore the scaling laws developed from custom data for each concept are subject to less design noise than say, regression based approaches. Through these laws, key physics-based characteristics of vehicle subsystems such as energy density can be mapped onto key system level metrics such as fuselage volume or take-off gross weight. These laws can then substitute some historical-data based analyses thereby improving the fidelity of the analyses and reducing design time.

Spray drying is a widely used unit operation for producing particulate products directly from a liquid feed. Important processes that occur inside the spray dryer are droplet formation, droplet drying and interactions between droplets and recycled fines. Various studies have looked at the first two processes, but the latter phenomenon has received less attention. Literature on droplet-particle interaction which aims at quantitatively describing agglomeration in spray drying is scarce and mainly qualitative. For product quality the formation of agglomerates is often desirable. This thesis models and investigates the collisions of individual particles with single droplets. The surface tack of drying droplets has been identified as an important variable for the formation of agglomerates. In this thesis a novel method for measuring tack from the liquid phase has been further improved. The improvements are a more accurate load measurement, an automated control of the tack probe and an improved layout of the sample holder and probe. The key feature of the device is its ability to measure tack of drying droplets, whereas other devices measure tack by wetting a powder. Using our method the tack of a commonly spray dried product, yeast extract, has been measured. From these experiments it was found that with decreasing average moisture content the surface tack increases to a maximum. Below a critical average moisture content the surface of the droplet is dry and the tack rapidly decreases upon further drying. Another important parameter in determining the degree of agglomeration is the degree of penetration. If the particle penetrates the droplet too deeply, the agglomerate structure becomes too dense. To predict the penetration depth, a non-dimensional model has been developed. It describes the penetration of a particle into a liquid droplet during a head-on collision. It is based on a force balance and incorporates surface tension force, viscous force and capillary pressure force. The important parameters determining the collision outcome are the contact angle, the size of the droplet relative to the particle, the Reynolds and Weber numbers. For each contact angle an equilibrium penetration position exists, at this point the surface tension force vector is perpendicular to the penetration direction. Five different penetrations regimes are identified. At low Reynolds numbers, viscous forces dominate and the particle asymptotically travels towards the equilibrium position. Reducing the viscous drag force by increasing the Reynolds number results in initially overshooting the equilibrium position, but the surface tension force pulls the particle back, to attain the equilibrium in an oscillating motion. At even higher Reynolds numbers the particle fully penetrates the droplet, and reaches the centre of the droplet for even higher values for the Reynolds number. The ejection regime is found at high Reynolds number and low Weber numbers and the liquid should be non-wetting. Using the regime maps one is able to identify in which region a spray dryer is operating. Although the full penetration regimes are useful for capturing fines, it should be avoided when agglomeration is desired. The ejection regime should be avoided as well. To validate the model, impact experiments were carried out by dropping glass spheres on the surface of different liquids. These validation experiments were the first attempt to experimentally validate the collision of a single particle with a liquid surface. Besides yeast extract, which has non-Newtonian rheological properties, silicone oils with constant viscosities of 100 mPa•s and 1 Pa•s have been tested. The penetration over time for different impact velocities was determined by analysing high speed camera recordings. The typical penetration times ranged from 0.2 s to 2 s. To obtain accurate location data was recorded at frame rates up to 38 000 frames per second. Glass spheres, with a size of 2 mm were used to allow the visual tracking. Modelling the impacts showed that the model consistently predicted faster penetration times than were observed experimentally. The relative difference increased with increasing viscosity. A parameter fitting exercise showed that better agreement could be obtained by using a higher viscosity and a higher contact angle in the model. With this knowledge the most likely factor influencing the model-experiment mismatch was identified as being the dynamics of wetting of the particle surface. It was also found that using the dynamic contact angle in the model would improve its results. The non-Newtonian characteristics of the yeast extract resulted in the particle rebound and the formation of an air cavity upon impact. The tack measurement technique and penetration model presented in this thesis will be useful tools for the design of spray dryers. Recommendations are made for further model improvement. The experimental validation is the first attempt to validate the presented model. Future improvements are recommended and suggestions are presented.

The requirement to operate vehicles in low light and/or night environments whilst wearing night vision goggle (NVG) systems has become increasingly common during military operations. There is very limited research investigating injury risks associated with these systems during ground vehicle collisions. This study examined the injury risks associated with wearing the Australian Defence Force - Enhanced Combat Helmet (ECH) and NVG system, in frontal vehicle collisions. This project consisted of two components: (1) crash tests using a sled and (2) numerical simulations of impacts. Four dynamic sled tests were conducted using a 50th percentile, male, Hybrid III dummy positioned on a rigid seat. Frontal impact tests were performed at a 40 km/h change in velocity (*v) and 20 g deceleration. The test configurations were as follows: (a) Base; (no helmet or additional equipment); (b) ECH; and, (c) ECH and NVG. Condition (c) was carried out twice, to determine repeatability. The sled test protocols were reconstructed precisely with the numerical simulation package MADYMO and the simulations were shown to correlate well with the experimental results. Using this validated model, four parametric studies were undertaken to assess the influence of counterweights, seat cushion, seatbelt pre-tensioner, and the vehicle's *v and acceleration on injury risks. The study found that neck loads were within acceptable limits, with the exception of the neck extension moment, which was exceeded for all NVG conditions. Based on the parametric studies, no major improvements were observed in the neck extension moments with the use of counterweights or a seat cushion. In contrast the use of a seatbelt pre-tensioner was observed to decrease greatly this neck injury risk in certain scenarios. The study also identified that a *v of 15 km/h and peak acceleration of up to 14 g were required to keep the neck extension moment below the prescribed injury criteria. However, the high neck extension moment values may have been partially attributable to the stiff Hybrid III neck. This study identified a possible injury mechanism for soldiers using the ECH and NVG system during specific impact scenarios. The method applied in this project was designed to be repeatable.

Positive-ion electrospray ionisation Fourier transform ion cyclotron resonance and ion trap mass spectrometry have been used to investigate the reactions of the flavonoids 3-hydroxyflavone, 5-hydroxyflavone, 5-methoxyflavoe, quercetin, quercitrin and rutin with monovalent Li+, Na+, K+ and Cs+, divalent Cu2+, Zn2+ and Pb2+ and trivalent La3+ and Eu3+ metal cations. The effect of capillary-skimmer potential difference and the ion residence time in the hexapole ion trap of the Fourier transform ion cyclotron resonance mass spectrometer are systematically investigated for the flavonoid-alkali and divalent metal ion experiment. It is observed that these variables impact significantly on the type of ions observed in the ESI experiments and hence the mass spectra. The binding selectivity of alkali metal ions towards 3-hydroxyflavone, 5-hydroxyflavone and 5-methoxyflavone are determined using the results from FTICR mass spectrometry experiments. The selectivity order follows the order Li+>Na+>K+ for individual flavonoids. Collision-induced dissociation experiments are carried out by Fourier transform ion cyclotron resonance and ion trap mass spectrometry to compare the fragmentation behaviour of metal-flavonoid complexes. Low energy collision-induced dissociation experiments of the [2L+M]+ for 3-hydroxyflavone, 5-hydroxyflavone and 5-methoxyflavone alkali metal complexes show the loss of ligand only. When the energy is increased only the lithiated dimer [2L+Li]+ for 5-methoxyflavone shows the loss of methyl radical along with the ligand. For quercitrin the predominant dissociation pathways are the loss of rhamnose for Li+, Na+ and K+ complexes although aglycone loss is also observed for the K+ complex. The favourable dissociation pathways for rutin are the loss of disaccharide, aglycone and rhamnose for the Na+ complex and the loss of disaccharide for the K+ complex. Collision-induced dissociation data are also used to determine the threshold dissociation energies for displacement of one flavonoid ligand from alkali metal flavonoid complexes. The threshold dissociation energies for loss of one ligand from [2L+M]+ of 5-methoxyflavone and quercitrin follow the order Li+ > Na+ > K+, rutin follows the order Na+ > K+ > Li+ , and 3-hydroxyflavone and 5-hydroxyflavone follow the order Li+ > Na+. For the same metal cation experiment, 5-methoxyflavone system has the highest dissociation energy compared to the 3-hydroxyflavone and 5-hydroxyflavone experiment. Preliminary DFT calculations show that the calculated dissociation energies follow the same trend as the experimental dissociation energies for the simple flavonoid alkali metal cation experiments. For 5-methoxyflavone-divalent metal cation (Zn2+, Cu2+ and Pb2+) complexes loss of methyl radical is the common process. CO loss is also observed for the Zn2+ complex whereas CHO and H2O losses are observed for Cu2+. For 3-hydroxyflavone and 5-hydroxyflavone divalent metal cation experiments loss of ligand is the dominant process. Zn2+ and Cu2+ complexes also show CO loss. La3+ and Er3+ with the same flavonoids show the ligand as the dominant product. For quercetin-divalent metal cation experiment, ligand loss is the dominant process. For quercitrin and rutin various dissociation products are observed where the dissociation occurs via the loss of the rhamnose and/or the disaccharide moieties. Similar dissociation patterns are also observed for La3+ and Er3+ complexes for quercitrin and rutin.

Thesis (M.S.)--Linköping University, 2004. / Includes bibliographical references (p. 63-64). Also available online via the VTI web site (www.vti.se).