Search results for " Phase"

showing 10 items of 1862 documents

Impact of the ΔPhe configuration on the Boc-Gly-ΔPhe-NHMe conformation: experiment and theory

2019

Conformational propensities of N-t-butoxycarbonyl-glycine-(E/Z)-dehydrophenylalanine N′-methylamides (Boc-Gly-(E/Z)-ΔPhe-NHMe) in chloroform were investigated by NMR and IR techniques. The low-temperature crystal structure of the E isomer was determined by single crystal X-ray diffraction and the experimental data were elaborated by theoretical calculations using DFT (B3LYP, M06-2X) and MP2 approaches. The β-turn tendencies for both isomers were determined in the gas phase and in the presence of solvent. The obtained results reveal that the configuration of ΔPhe residue significantly affects the conformations of the studied dehydropeptides. The tendency to adopt β-turn conformations is sign…

Diffractionβ-turn tendencyCrystal structure010402 general chemistry01 natural sciencesGas phaseX-ray crystal structure analysischemistry.chemical_compoundResidue (chemistry)Peptide conformational analysisZ isomer0103 physical sciencesPhysical and Theoretical Chemistry13C NMRChloroform010304 chemical physicsDehydrophenylalanineE isomer1H NMRCondensed Matter Physics0104 chemical sciencesSolventCrystallographychemistryIR spectroscopyDFT-GIAO calculationsSingle crystalStructural Chemistry
researchProduct

Specific Heat and Transport Functions of Water

2020

Numerous water characteristics are essentially ascribed to its peculiarity to form stronghydrogen bonds that become progressively more stable on decreasing the temperature. However, thestructural and dynamical implications of the molecular rearrangement are still subject of debate andintense studies. In this work, we observe that the thermodynamic characteristics of liquid water arestrictly connected to its dynamic characteristics. In particular, we compare the thermal behaviourof the isobaric specific heat of water, measured in different confinement conditions at atmosphericpressure (and evaluated by means of theoretical studies) with its configurational contribution obtainedfrom the value…

Diffusivity; Phase transition; Specific heat; WaterMaterials scienceHot TemperatureLiquid waterwater; phase transition; specific heat; diffusivityEntropywaterThermodynamics02 engineering and technologyspedific heat01 natural sciencesHeat capacityCatalysisArticleInorganic Chemistrylcsh:ChemistryDiffusionDiffusivity0103 physical sciencesThermalPhysical and Theoretical ChemistryMolecular rearrangement010306 general physicsMolecular Biologylcsh:QH301-705.5SpectroscopySpecific heatOrganic ChemistryGeneral MedicineModels Theoretical021001 nanoscience & nanotechnologySettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)Computer Science ApplicationsCold Temperaturelcsh:Biology (General)lcsh:QD1-999phase transitionIsobaric processThermodynamicsSpecific heat0210 nano-technology
researchProduct

Insights into the compositional evolution of crustal magmatic systems from coupled petrological-geodynamical models

2020

Funding was provided by the VAMOS Research Center, University of Mainz (Germany) and by the ERC Consolidator Grant MAGMA (project #771143). The evolution of crustal magmatic systems is incompletely understood, as most studies are limited either by their temporal or spatial resolution. Exposed plutonic rocks represent the final stage of a long-term evolution punctuated by several magmatic events with different chemistry and generated under different mechanical conditions. Although the final state can be easily described, the nature of each magmatic pulse is more difficult to retrieve. This study presents a new method to investigate the compositional evolution of plutonic systems while consid…

Dike010504 meteorology & atmospheric sciencesHighly evolved rocksCoupled petrological-geodynamical models010502 geochemistry & geophysics01 natural sciencesLong-lived mush chambersSillGeochemistry and PetrologyPetrology0105 earth and related environmental sciencesgeographygeography.geographical_feature_categoryFractional crystallization (geology)GELarge phase diagram databaseContinental crustPartial meltingDASDepletion of rocks through dikingGeophysics13. Climate actionMagmaMagmatismIgneous differentiationGeologyGE Environmental SciencesJournal of Petrology
researchProduct

Positive solutions for singular (p, 2)-equations

2019

We consider a nonlinear nonparametric Dirichlet problem driven by the sum of a p-Laplacian and of a Laplacian (a (p, 2)-equation) and a reaction which involves a singular term and a $$(p-1)$$ -superlinear perturbation. Using variational tools and suitable truncation and comparison techniques, we show that the problem has two positive smooth solutions.

Dirichlet problemApplied MathematicsGeneral Mathematics010102 general mathematicsNonparametric statisticsSingular termGeneral Physics and AstronomyPerturbation (astronomy)Mathematics::Spectral Theory01 natural sciences010101 applied mathematicsNonlinear systemSettore MAT/05 - Analisi MatematicaSingular term Superlinear perturbation Positive solution Nonlinear regularity Truncation Maximum principle Double phase problemApplied mathematics0101 mathematicsLaplace operatorMathematicsZeitschrift für angewandte Mathematik und Physik
researchProduct

Multiple solutions for parametric double phase Dirichlet problems

2020

We consider a parametric double phase Dirichlet problem. Using variational tools together with suitable truncation and comparison techniques, we show that for all parametric values [Formula: see text] the problem has at least three nontrivial solutions, two of which have constant sign. Also, we identify the critical parameter [Formula: see text] precisely in terms of the spectrum of the [Formula: see text]-Laplacian.

Dirichlet problemlocal minimizersTruncationApplied MathematicsGeneral MathematicsMusielak-Orlicz-Sobolev spacesDirichlet distributionsymbols.namesakeDouble phaseSettore MAT/05 - Analisi MatematicaDouble phase integrandsymbolseigenvalues of the q-LaplacianApplied mathematicsSettore MAT/03 - Geometriaunbalanced growthParametric statisticsMathematics
researchProduct

Any AND-OR Formula of Size N Can Be Evaluated in Time $N^{1/2+o(1)}$ on a Quantum Computer

2007

Consider the problem of evaluating an AND-OR formula on an $N$-bit black-box input. We present a bounded-error quantum algorithm that solves this problem in time $N^{1/2+o(1)}$. In particular, approximately balanced formulas can be evaluated in $O(\sqrt{N})$ queries, which is optimal. The idea of the algorithm is to apply phase estimation to a discrete-time quantum walk on a weighted tree whose spectrum encodes the value of the formula.

Discrete mathematicsQuantum t-designComputational complexity theoryGeneral Computer ScienceGeneral MathematicsSpectrum (functional analysis)Value (computer science)0102 computer and information sciencesTree (graph theory)01 natural sciencesCombinatoricsTree (descriptive set theory)Discrete time and continuous time010201 computation theory & mathematics0103 physical sciencesQuantum operationQuantum phase estimation algorithmQuantum Fourier transformQuantum walkQuantum algorithm010306 general physicsMathematicsQuantum computerSIAM Journal on Computing
researchProduct

Quantum Random Walks – New Method for Designing Quantum Algorithms

2008

Quantum walks are quantum counterparts of random walks. In the last 5 years, they have become one of main methods of designing quantum algorithms. Quantum walk based algorithms include element distinctness, spatial search, quantum speedup of Markov chains, evaluation of Boolean formulas and search on "glued trees" graph. In this talk, I will describe the quantum walk method for designing search algorithms and show several of its applications.

Discrete mathematicsTheoretical computer scienceHeterogeneous random walk in one dimensionQuantum annealingTheoryofComputation_GENERALRandom walkMathematics::ProbabilitySearch algorithmComputerSystemsOrganization_MISCELLANEOUSQuantum phase estimation algorithmQuantum algorithmQuantum walkQuantum computerMathematics
researchProduct

Copolymerization of VDF and HFP in Supercritical Carbon Dioxide: A Robust Approach for Modeling Precipitation and Dispersion Kinetics

2012

A kinetic model is developed for the heterogeneous free-radical copolymerization of vinylidene fluoride and hexafluoropropylene in supercritical CO 2. The model accounts for polymerization in both the dispersed (polymer-rich) phase and in the continuous (polymer-free) supercritical phase, for radical interphase transport, diffusion limitations, and chain-length-dependent termination in the polymer-rich phase. A parameter evaluation strategy is developed and detailed to estimate most of the kinetic parameters a priori while minimizing their evaluation by direct fitting. The resulting model predictions compare favorably with the experimental results of conversion and MWD at varying monomer fe…

Dispersion kineticChain-length-dependent terminationDiffusionSupercritical carbon dioxideSupercritical phaseCopolymerCopolymerizationKineticRobust approacheHexafluoropropyleneModel predictionFree radical polymerizationFree radical copolymerizationKinetic modelPolymers Supercritical fluid extractionSettore ING-IND/27 - Chimica Industriale E TecnologicaDiffusion limitationFluorine containing polymerMonomerParameter evaluationVinylidene fluoride Carbon dioxideHeterogeneous polymerizationMonomer concentrationFeed compositionSupercritical COModel
researchProduct

Generation of Bound States of Three Ultrashort Pulses With a Passively Mode-Locked High-Power Yb-Doped Double-Clad Fiber Laser

2004

We report the generation of high-power ultrashort bound states of three pulses in an ytterbium-doped double-clad fiber laser. The laser is mode-locked through nonlinear polarization rotation technique in a unidirectional cavity configuration. A pair of diffraction grating is incorporated in the cavity to compensate for the normal dispersion of the fiber. The laser generates chirped bound states of three pulses with either equal or different time separations, with more than 500-pJ energy per pulse. These pulses are subsequently compressed to 100 fs with a compression factor of more than 40.

Distributed feedback laserMaterials sciencebusiness.industryPhysics::OpticsNonlinear opticsLaserAtomic and Molecular Physics and OpticsElectronic Optical and Magnetic Materialslaw.inventionDouble-clad fiberOpticsMultiphoton intrapulse interference phase scanlawFiber laserUltrafast laser spectroscopyDispersion (optics)OptoelectronicsPhysics::Atomic PhysicsElectrical and Electronic EngineeringbusinessIEEE Photonics Technology Letters
researchProduct

A general procedure for the construction of Gorges polygons for multi-phase windings of electrical machines

2018

This paper presents a simple and effective procedure for the determination of the Gorges polygon, suitable for all possible winding configurations in electrical machines. This methodology takes into account the determination of a Winding Distribution Table (WDT), in which all the information about the distribution of the currents along the stator periphery is computed and from which the Görges polygon are easily derived. The proposed method can be applied to both symmetrical and asymmetrical multi-phase windings, including concentrated, fractional, reduced and dead-coil ones. The examples provided in this paper demonstrate the versatility of the proposed method.

Distribution (number theory)Computer scienceMulti phaseStator020209 energy02 engineering and technologySettore ING-IND/32 - Convertitori Macchine E Azionamenti ElettriciTopologylaw.inventionHarmonic analysisstar of slotsElectrical machineSimple (abstract algebra)lawElectrical machinesdead-coil windings0202 electrical engineering electronic engineering information engineeringreduced systemsAsymmetrical windingElectrical machines winding design symmetrical winding asymmetrical winding reduced systems dead-coil windings star of slots.Renewable Energy Sustainability and the Environmentwinding designreduced systemstar of slotVisualizationElectromagnetic coilAutomotive EngineeringPolygonsymmetrical windingdead-coil winding2018 Thirteenth International Conference on Ecological Vehicles and Renewable Energies (EVER)
researchProduct