Search results for " Couplings"
showing 10 items of 30 documents
Model-Based Evaluation of Methods for Respiratory Sinus Arrhythmia Estimation
2021
OBJECTIVE: Respiratory sinus arrhythmia (RSA) refers to heart rate oscillations synchronous with respiration, and it is one of the major representations of cardiorespiratory coupling. Its strength has been suggested as a biomarker to monitor different conditions, and diseases. Some approaches have been proposed to quantify the RSA, but it is unclear which one performs best in specific scenarios. The main objective of this study is to compare seven state-of-the-art methods for RSA quantification using data generated with a model proposed to simulate, and control the RSA. These methods are also compared, and evaluated on a real-life application, for their ability to capture changes in cardior…
Seawater Desalination for Freshwater Production
2009
In the last decades more and more countries have experienced water scarcity problems, thus pointing at alternative non-conventional sources of fresh water. Seawater desalination has proven to be a reliable and economically sustainable water resource since the second half of the 20th Century. A number of well proven technologies already exist, with advantages and disadvantages making each of them more suitable in specific sites. Moreover, quite recently, coupling the use of renewable energy to the production of fresh water from seawater results in novel technologies, able to minimise the environmental impact that desalination processes can create due to their intense energy consumptions.
Gold(I) Complexes of Ferrocenyl Polyphosphines: Aurophilic Gold Chloride Formation and Phosphine-Concerted Shuttling of a Dinuclear [ClAu···AuCl] Fra…
2016
International audience; A smart steric control of the metallocene backbone in bis- and poly(phosphino)ferrocene ligands favors intramolecular aurophilic interactions between [AuCl] fragments in polynuclear gold(I) complexes. We synthesized and characterized by multinuclear NMR and X-ray diffraction analysis mono-, di-, and polynuclear gold complexes of constrained ferrocenyl diphosphines, which bear either bulky tert-butyl groups or more flexible siloxane substituents at the cyclopentadienyl rings. The complexes meso-1,1'-bis-(diphenylphosphino)-3,3'-di-tert-butylferrocene (4-m), rac-1,1'-bis[bis-(5-methy1-2-furyl)phosphino]-3,3'-di-tert-butyfferrocene (5-r), and rac-1,1'-bis ( diphenylphos…
Investigation of the Thermomechanical Response of Cyclically Loaded NiTi Alloys by Means of Temperature Frequency Domain Analyses
2021
Nickel–Titanium (NiTi) shape memory alloys subjected to cyclic loading exhibit reversible temperature changes whose modulation is correlated with the applied load. This reveals the presence of reversible thermomechanical heat sources activated by the applied stresses. One such source is the elastocaloric effect, accounting for the latent heat of Austenite–Martensite phase transformation. It is, however, observed that when the amplitude of cyclic loads is not sufficient to activate or further propagate this phase transformation, the material still exhibits a strong cyclic temperature modulation. The present work investigates the thermomechanical behaviour of NiTi under such low-amplitude cyc…
Théorie des spectres rovibroniques des molécules octaédriques : Hamiltonien et moments de transition
2002
This thesis is devoted to the treatment of rovibronic couplings of octahedral species for which the Born-Oppenheimer approximation is broken down. By using the octahedral formalism, a full effective rovibronic model is extended from works about molecules in a non-degenerate electronic state. This effective model is dedicated to molecules with an odd or an even number of electrons and it has been successfully applied to V(CO)6 and ReF6. For both of them we have four interacting vibronic sublevels attributed to a dynamical Jahn-Teller effect and giving rise to very complicated spectra. This model is validated by the overall agreement between predicted and observed band profiles. Moreover, an …
Measurement of the W boson polarization in top quark decays with the ATLAS detector
2012
This paper presents measurements of the polarization of W bosons in top quark decays, derived from t¯t events with missing transverse momentum, one charged lepton and at least four jets, or two charged leptons and at least two jets. Data from pp collisions at a centre-of-mass energy of 7 TeV were collected with the ATLAS experiment at the LHC and correspond to an integrated luminosity of 1.04 fb−1. The measured fractions of longitudinally, left- and right-handed polarization are F0 = 0.67 ± 0.07, FL = 0.32 ± 0.04 and FR = 0.01 ± 0.05, in agreement with the Standard Model predictions. As the polarization of the W bosons in top quark decays is sensitive to the Wtb vertex Lorentz structure and…
ATLAS Inner Detector alignment and analysis of the Wtb vertex structure with single top quarks
2018
Esta tesis puede ser dividida en dos partes diferentes: La primera trata sobre el alineamiento del detector interno de ATLAS, y la segunda sobre el estudio de la estructura del vértice Wtb mediante el uso de quarks top producidos en solitario. La primera parte presenta las técnicas utilizadas para alinear el detector interno de ATLAS, así como las mejoras implementadas en algoritmo de alineamiento durante el Run-II del LHC. Durante la toma de datos, tienen lugar en el detector interno diversos movimientos y deformaciones dinámicos que comprometen la calidad de los datos recogidos. Los dos más relevantes son un movimiento vertical del detector de Píxeles, y el combado del IBL. En el alineami…
Spectroscopie des hexafluorures à nombre impair d'électrons
1995
From a theoretical point of view, a tensorial formalism adapted to the study of molecules or octahedral ions with a half-integer angular momentum has been developed for the first time. We have used here the method of projective representations, more consistent than that of double groups. A complete set of coupling coefficients and formulas, as well as the corresponding computing programs have been elaborated. This has firstly allowed to write a simple model describing the vibronic structure of colored hexafluorides. Then, somme applications of this formalism to the study of rovibronic couplings of XY6 molecules in a fourfold degenerate electronic state have been considered, especially conce…
Structure and dynamics in liquid bismuth and Bin clusters: A density functional study
2014
Density functional/molecular dynamics simulations with more than 500 atoms have been performed on liquid bismuth at 573, 773, 923, and 1023 K and on neutral Bi clusters with up to 14 atoms. There are similar structural patterns (coordination numbers, bond angles, and ring patterns) in the liquid and the clusters, with significant differences from the rhombohedral crystalline form. We study the details of the structure (structure factor, pair, and cavity distribution functions) and dynamical properties (vibration frequencies, diffusion constants, power spectra), and compare with experimental results where available. While the three short covalent bonds typical to pnictogens are characteristi…
Quantum coherent manipulation of spin information in molecular nanomagnets
2023
Los sistemas cuánticos de dos niveles basados en estados de espín, conocidos como ``qubits de espín'', son bloques prometedores para el desarrollo de tecnologías cuánticas. Entre las distintas plataformas físicas, los qubits de espín definidos en imanes de molécula única (SMM) son candidatos prometedores porque su estructura electrónica puede ajustarse fácilmente mediante ingeniería química (es decir, el Hamiltoniano de espín molecular puede modificarse con facilidad). Sin embargo, los qubits moleculares de espín generados en SMM se enfrentan a varios retos: coherencia cuántica frágil, control coherente insuficiente de los estados de espín y generación de entrelazamiento entre los qubits de…