Search results for "Dynamic"

Numerical methods for a nonlinear impact model: A comparative study with closed-form corrections

2011

A physically based impact model-already known and exploited in the field of sound synthesis-is studied using both analytical tools and numerical simulations. It is shown that the Hamiltonian of a physical system composed of a mass impacting on a wall can be expressed analytically as a function of the mass velocity during contact. Moreover, an efficient and accurate approximation for the mass outbound velocity is presented, which allows to estimate the Hamiltonian at the end of the contact. Analytical results are then compared to numerical simulations obtained by discretizing the system with several numerical methods. It is shown that, for some regions of the parameter space, the trajectorie…

Multimode Representation of the Magnetic Field for the Analysis of the Nonlinear Behavior of Solar Activity as a Driver of Space Weather

2022

ISSP UL as the Center of Excellence is supported through the Framework Program for European universities Union Horizon 2020, H2020-WIDESPREAD-01-2016-2017-TeamingPhase2 under Grant Agreement No. 739508, CAMART2 project; Internal Foundation of University of Maryland.

Modelling flow and heat transfer in spacer-filled membrane distillation channels using open source CFD code

2013

Abstract A good understanding of the details of hydrodynamic and heat transport conditions and their impact on temperature polarisation and pressure drops is essential for optimum design of membrane distillation (MD) modules. To this end, the present work reports on initial progress in the development of a tool for 3D simulation of spacer-filled MD channels based on the open source CFD code library OpenFOAM. The paper discusses a number of modelling and implementation aspects including model geometry and computational domain, choice of boundary conditions, and discretisation schemes. The results pertaining to the effect of three different spacer types on the fluid dynamics and heat transfer…

Continuum: A spatiotemporal data model to represent and qualify filiation relationships

2013

International audience; This work introduces an ontology-based spatio-temporal data model to represent entities evolving in space and time. A dynamic phenomenon generates a complex relationship network between the entities involved in the process. At the abstract level, the relationships can be identity or topological filiations. The existence of an identity filiation depends on whether the object changes its identity or not. On the other hand, topological filiations are based exclusively on the spatial component, like in the case of growth, reduction, merging or splitting. When combining identity and topological filiations, six filiation relationships are obtained, forming a second abstrac…

Analysing spatial dynamics using cellular automata-based artificial neural networks

2015

La modélisation de l'information spatio-temporelle

2012

Understanding Urban Fabric with the OH_FET model based on Social Use, Space and Time

2008

The proposed principle for understanding the urban fabric is based on considering the town as a set of complex objects, taking a systemic approach. The town system used to study the urban fabric over large time spans is composed of three sub-systems relating to historical objects from the level of the excavation to that of the former urban space: function (social use), space (location, surface area and morphology) and time (dating, duration and chronology). The historical object is the analytical unit of the space studied. It is the Cartesian product of the three sets, Social use, Space and Time, from which it stems. On the basis of this process, the Historical Object (OH) is broken down in…

Thermodynamic and spectroscopic study of the binding of dimethyltin(IV) by citrate at 25°C

2006

Thermodynamic (potentiometric and calorimetric) and spectroscopic ( 1 H NMR, 119 Sn Mossbauer) studies were performed in aqueous solution in order to characterize the interaction of dimethyltin(IV) cation with citrate ligand. Six species {(CH 3 ) 2 Sn(cit) - ; [(CH 3 ) 2 Sn] 2 (cit) 2 2- ; (CH 3 ) 2 Sn(cit)H 0 ; (CH 3 ) 2 Sn(cit)OH 2- ; [(CH 3 ) 2 Sn] 2 (cit)OH 0 ; [(CH 3 ) 2 Sn] 2 (cit)(OH) 2 - } were found. All the species formed in this system are quite stable and formation percentages are fairly high. For example, at pH = 7.5 and C (CH3)2Sn = C cit = 10 mmol l -1 , E% for [(CH 3 ) 2 Sn] 2 (cit)(OH) 2 - and (CH 3 ) 2 Sn(cit)OH 2- species reaches 65%. Overall thermodynamic parameters obta…

A Theoretical and Experimental Investigation of the Spectroscopic Properties of a DNA-Intercalator Salphen-Type ZnIIComplex

2014

The photophysical and DNA-binding properties of the cationic zinc(II) complex of 5-triethylammonium methyl salicylidene ortho-phenylenediiminato (ZnL 2 + ) were investi- gated by a combination of experimental and theoretical methods. DFT calculations were performed on both the ground and the first excited states of ZnL 2 + and on its possi- ble mono- and dioxidation products, both in vacuo and in selected solvents mimicked by the polarizable continuum model. Comparison of the calculated absorption and fluores- cence transitions with the corresponding experimental data led to the conclusion that visible light induces a two-elec- tron photooxidation process located on the phenylenediimi- nato…

Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

2020

Over the last few years, extraordinary advances in experimental and theoretical tools have allowed us to monitor and control matter at short time and atomic scales with a high degree of precision. An appealing and challenging route toward engineering materials with tailored properties is to find ways to design or selectively manipulate materials, especially at the quantum level. To this end, having a state-of-the-art ab initio computer simulation tool that enables a reliable and accurate simulation of light-induced changes in the physical and chemical properties of complex systems is of utmost importance. The first principles real-space-based Octopus project was born with that idea in mind,…