Search results for "imulation"

showing 10 items of 7271 documents

Channel aggregation with guard-band in D-OFDM based CRNs: Modeling and performance evaluation

2016

Channel aggregation (CA) techniques can offer flexible channel allocation and improve overall system performance in multi-channel cognitive radio networks (CRNs). Although many CA techniques have been proposed and studied, the impact of guard-band on CA for channel access has not been addressed in-depth. In this paper, we study the guard-band allocation mechanisms in discontinuous-orthogonal frequency division multiplexing (D-OFDM) based CRNs, and investigate the impact of guard-band sharing on SU flows when CA is enabled. Continuous time Markov chain (CTMC) based models have been developed in order to investigate the stochastic behavior of PU and SU flows. Based on our mathematical analysi…

Channel allocation schemesComputer scienceOrthogonal frequency-division multiplexingDistributed computingBandwidth (signal processing)Guard bandMarkov process020206 networking & telecommunications02 engineering and technologyFrequency-division multiplexingsymbols.namesakeCognitive radio0202 electrical engineering electronic engineering information engineeringsymbols020201 artificial intelligence & image processingSimulationCommunication channel2016 IEEE Wireless Communications and Networking Conference
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SHARING THE BENEFITS OF COOPERATION IN HIGH SEAS FISHERIES: A CHARACTERISTIC FUNCTION GAME APPROACH

1998

Characteristic function (convex analysis)0208 environmental biotechnology02 engineering and technology010501 environmental sciencesEnvironmental Science (miscellaneous)01 natural sciencesShapley value020801 environmental engineeringMicroeconomicsInternational watersModeling and SimulationEconomicsMathematical economics0105 earth and related environmental sciencesNatural Resource Modeling
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Thermomechanical effects in the flow of a fluid in porous media

2002

This paper deals with analysis, by methods of extended thermodynamics, of the thermomechanical effects which arise in the flow of a weakly viscous fluid in a porous medium. Under the hypothesis that the fluid fills all the interstices among the powder and that the size of the powder grains and of the interstices is much lower than a suitable characteristic length, linearized field equations are written, which include, in a natural way, terms which take into account the Dufour, Soret, and virtual mass effects. As a limiting case when the evolution time of the heat flux goes to infinite and no entropy flux is carried, the flow of liquid helium II in a porous medium is obtained.

Characteristic lengthThermodynamicsViscous liquidComputer Science ApplicationsPhysics::Fluid DynamicsHeat fluxModeling and SimulationMass transferModelling and SimulationHeat transferFluid dynamicsBoundary value problemPorous mediumMathematicsMathematical and Computer Modelling
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Application of Genetic Algorithm on Parameter Optimization of Three Vehicle Crash Scenarios

2017

Abstract This paper focuses on the development of mathematical models for vehicle frontal crashes. The models under consideration are threefold: a vehicle into barrier, vehicle-occupant and vehicle to vehicle frontal crashes. The first model is represented as a simple spring-mass-damper and the second case consists of a double-spring-mass-damper system, whereby the front mass and the rear mass represent the vehicle chassis and the occupant, respectively. The third model consists of a collision of two vehicles represented by two masses moving in opposite directions. The springs and dampers in the models are nonlinear piecewise functions of displacements and velocities respectively. More spec…

ChassisComputer scienceModeling010103 numerical & computational mathematics02 engineering and technologyCollision01 natural sciencesCrash testfrontal crashvehicle-occupantDamperNonlinear system020303 mechanical engineering & transports0203 mechanical engineeringControl theoryControl and Systems EngineeringGenetic algorithmparameters estimationgenetic algorithm0101 mathematicsSimulationfrontal crash; genetic algorithm; Modeling; parameters estimation; vehicle-occupant; Control and Systems EngineeringMotor vehicle crash
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Numerical investigations of single mode gyrotron equation

2009

A stationary problem with the integral boundary condition arising in the mathematical modelling of a gyrotron is numerically investigated. The Chebyshev's polynomials of the second kind are used as the tool of calculations. The main result with physical meaning is the possibility to determine the maximal value of electrons efficiency. First published online: 14 Oct 2010

Chebyshev polynomialsMathematical analysisSingle-mode optical fiberElectronChebyshev filterfinite‐difference schemeslaw.inventionChebyshev's polynomials of the second kindlawModeling and SimulationGyrotronQA1-939Boundary value problemMathematicsAnalysismathematical modelling of gyrotronMathematicsMathematical Modelling and Analysis
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On interactive multiobjective optimization with NIMBUS® in chemical process design

2005

We study multiobjective optimization problems arising from chemical process simulation. The interactive multiobjective optimization method NIMBUS®, developed at the University of Jyvaskyla, is combined with the BALAS® process simulator, developed at the VTT Technical Research Center of Finland, in order to provide a new interactive tool for designing chemical processes. Continuous interaction between the method and the designer provides a new efficient approach to explore Pareto optimal solutions and helps the designer to learn about the behaviour of the process. As an example of how the new tool can be used, we report the results of applying it in a heat recovery system design problem rela…

Chemical processPareto optimalMathematical optimizationComputer scienceProcess (engineering)Strategy and ManagementHeat recovery ventilationGeneral Decision SciencesProcess designProcess simulationMulti-objective optimizationIndustrial engineeringResearch centerJournal of Multi-Criteria Decision Analysis
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Short hydrogen bonds enhance nonaromatic protein-related fluorescence

2021

Significance Intrinsic fluorescence of nonaromatic amino acids is a puzzling phenomenon with an enormous potential in biophotonic applications. The physical origins of this effect, however, remain elusive. Herein, we demonstrate how specific hydrogen bond networks can modulate fluorescence. We highlight the key role played by short hydrogen bonds, present in the protein structure, on the ensuing fluorescence. We provide detailed experimental and molecular evidence to explain these unusual nonaromatic optical properties. Our findings should benefit the design of novel optically active biomaterials for applications in biosensing and imaging.

Chemical transformationOptics and PhotonicsGlutamineIntrinsic fluorescenceMolecular Dynamics SimulationPhotochemistryFluorescenceAb initio molecular dynamicsAmmoniaHumansSingle amino acidshort hydrogen bondDensity Functional TheoryMultidisciplinaryHydrogen bondChemistryintrinsic fluorescenceultraviolet fluorescenceHydrogen BondingConical intersectionFluorescenceBiophysics and Computational BiologyExcited statePhysical Sciences408PeptidesProceedings of the National Academy of Sciences of the United States of America
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Assessment of the Potential Energy Hypersurfaces in Thymine within Multiconfigurational Theory: CASSCF vs. CASPT2

2016

The present study provides new insights into the topography of the potential energy hypersurfaces (PEHs) of the thymine nucleobase in order to rationalize its main ultrafast photochemical decay paths by employing two methodologies based on the complete active space self-consistent field (CASSCF) and the complete active space second-order perturbation theory (CASPT2) methods: (i) CASSCF optimized structures and energies corrected with the CASPT2 method at the CASSCF geometries and (ii) CASPT2 optimized geometries and energies. A direct comparison between these strategies is drawn, yielding qualitatively similar results within a static framework. A number of analyses are performed to assess t…

Chemistry Multidisciplinary2-DIMENSIONAL ELECTRONIC SPECTROSCOPYPharmaceutical Sciencephotostability0305 Organic Chemistry01 natural sciencesLOWEST TRIPLET-STATEAnalytical ChemistryInterpretation (model theory)Molecular dynamicschemistry.chemical_compoundComputational chemistryDrug DiscoveryComplete active spacePerturbation theoryRETINAL CHROMOPHORE MODELComputingMilieux_MISCELLANEOUSAB-INITIOphotochemistry010304 chemical physicsBasis (linear algebra)ChemistryCOUPLED-CLUSTER METHODSPhotochemical ProcessesPotential energy[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistryChemistryChemistry (miscellaneous)2ND-ORDER PERTURBATION-THEORYPhysical SciencesANO BASIS-SETSCASSCF/CASPT2Molecular MedicineThermodynamicsLife Sciences & BiomedicineBiochemistry & Molecular BiologyField (physics)INITIO MOLECULAR-DYNAMICSMolecular Dynamics Simulation010402 general chemistryMolecular physicsArticlelcsh:QD241-441lcsh:Organic chemistryCASSCF/CASPT2; photochemistry; DNA; thymine; photostability0103 physical sciencesthyminePhysical and Theoretical ChemistryULTRAFAST INTERNAL-CONVERSIONScience & TechnologyOrganic ChemistryDNAEXCITED-STATE DYNAMICS0104 chemical sciencesThymineModels ChemicalMolecules; Volume 21; Issue 12; Pages: 1666
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Revised Atomistic Models of the Crystal Structure of C–S–H with high C/S Ratio

2016

Abstract The atomic structure of calcium-silicate-hydrate (C1.67–S–H x ) has been studied. Atomistic C–S–H models suggested in our previous study have been revised in order to perform a direct comparison of energetic stability of the different structures. An extensive set of periodic structures of C–S–H with variation of water content was created, and then optimized using molecular dynamics with reactive force field ReaxFF and quantum chemical semiempirical method PM6. All models show organization of water molecules inside the structure of C–S–H. The new geometries of C–S–H, reported in this paper, show lower relative energy with respect to the geometries from the original definition of C–S…

Chemistry0211 other engineering and technologiesStructure (category theory)ThermodynamicsTobermorite02 engineering and technologyCrystal structure021001 nanoscience & nanotechnologyC-S-H Structure ; Atomistic Simulation ; ReaxFF Force Field ; Semiempirical Quantum ChemistryStability (probability)Physical ChemistryInorganic ChemistryMolecular dynamics021105 building & constructionTheoretical chemistryPhysical chemistryMoleculePhysical and Theoretical ChemistryReaxFF0210 nano-technologyTheoretical Chemistry
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Prediction of acute toxicity of organophosphorus pesticides using topological indices

2007

Topological indices were used in the prediction of the acute toxicity (intraperitoneal and oral LD(50)) of organophosphorus pesticides on rats. Models with six variables for the prediction of LD(50)-i.p. (r = 0.849, Q(2) = 0.613) and eight variables for LD(50)-oral (r = 0.906, Q(2) = 0.701) were selected. External group and cross-validation by use of leave-n-out tests were also performed in order to assess the stability and the prediction performance of the selected topological models.

ChemistryAdministration OralQuantitative Structure-Activity RelationshipBioengineeringGeneral MedicineTopologyAcute toxicityRatsLethal Dose 50Organophosphorus CompoundsDrug DiscoveryAnimalsRegression AnalysisMolecular MedicineComputer SimulationPesticidesOrganophosphorus pesticidesInjections IntraperitonealSAR and QSAR in Environmental Research
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