Search results for "Application"

showing 10 items of 5559 documents

Estimation of formamide harmonic and anharmonic modes in the Kohn-Sham limit using the polarization consistent basis sets.

2010

Formamide harmonic and anharmonic frequencies of fundamental vibrations in the gas phase and in several solvents were successfully estimated in the B3LYP Kohn-Sham complete basis set limit (KS CBS). CBS results were obtained by extrapolating a power function (two-parameter formula) to the results calculated with polarization-consistent basis sets. Anharmonic corrections using the second order perturbation treatment (PT2) and hybrid B3LYP functional combined with polarization consistent pc-n (n = 0, 1, 2, 3, 4) and several Pople’s basis sets were analyzed for all fundamental formamide vibrational modes in the gas phase and solution. Solvent effects were modeled within a PCM method. The anhar…

FormamideAcetonitrilesMolecular ConformationAnharmonic vibrationSolvent effectMolecular physicsCatalysisInorganic ChemistryAcetonechemistry.chemical_compoundComputational chemistryScissoringHexanesComputer SimulationDimethyl SulfoxideHarmonic vibrationPhysical and Theoretical ChemistryPhysics::Chemical PhysicsCarbon TetrachlorideBasis setQuantitative Biology::BiomoleculesOriginal PaperFormamidesOrganic ChemistryAnharmonicityWaterComplete basis set limitFormamideComputer Science ApplicationsComputational Theory and MathematicschemistryModels ChemicalMolecular vibrationHarmonicSolventsThermodynamicsFermi resonanceChloroformGasesSolvent effectsJournal of molecular modeling
researchProduct

Ammonium formate-Pd/C as a new reducing system for 1,2,4-oxadiazoles. Synthesis of guanidine derivatives and reductive rearrangement to quinazolin-4-…

2021

1,2,4-Oxadiazole is a heterocycle with wide reactivity and many useful applications. The reactive O-N bond is usually reduced using molecular hydrogen to obtain amidine derivatives. NH4CO2H-Pd/C is here demonstrated as a new system for the O-N reduction, allowing us to obtain differently substituted acylamidine, acylguanidine and diacylguanidine derivatives. The proposed system is also effective for the achievement of a reductive rearrangement of 5-(2′-aminophenyl)-1,2,4-oxadiazoles into 1-alkylquinazolin-4(1H)-ones. The alkaloid glycosine was also obtained with this method. The obtained compounds were preliminarily tested for their biological activity in terms of their cytotoxicity, induce…

Formatesquinazolin-4-onemedicine.disease_causeGuanidineschemistry.chemical_compoundBiology (General)CytotoxicityAmmonium formateSpectroscopyOxadiazolesMolecular StructureChemistryAlkaloidBiological activityGeneral MedicineComputer Science ApplicationsChemistryOxidation-ReductionPalladiumCell SurvivalQH301-705.5Dipeptidyl Peptidase 4chemistry.chemical_elementAntineoplastic AgentsreductionArticleCatalysisInorganic ChemistryAmidine4-oxadiazolereduction;Cell Line TumorDiabetes MellitusAmmonium formatemedicineHumansHypoglycemic AgentsReactivity (chemistry)Physical and Theoretical ChemistryMolecular BiologyQD1-999QuinazolinonesSettore MED/04 - Patologia GeneralediacylguanidineOrganic Chemistry124-oxadiazolealpha-GlucosidasesacylguanidineSettore CHIM/06 - Chimica OrganicapalladiumCombinatorial chemistryModels ChemicalA549 CellsOxidative stress
researchProduct

Effects of timing of formative feedback in computer‐assisted learning environments

2020

Formative assessmentReading comprehensionComputer scienceHuman–computer interactionQuestion answeringComputer assisted learningComputer-Assisted InstructionCorrective feedbackComputer Science ApplicationsEducationJournal of Computer Assisted Learning
researchProduct

ATR-FTIR spectroscopy for the routine quality control of exosome isolations

2021

Abstract Exosomes are nanosized vesicles containing specific cargos of DNA, RNA, proteins, metabolites, and intracellular and membrane lipids. Exosome isolation needs to be optimized carefully depending on the type of biofluid and tissue and the retrieved exosomes need to be characterized. The main objective of this study was to determine the feasibility of a multimodal analysis of Attenuated Total Reflectance – Fourier Transform Infrared (ATR-FTIR) spectroscopy and UPLC–QqTOF-MSMS for the development of a routine quality control tool of isolated exosomes and the rapid characterization of their lipid profiles and total protein content. Using human milk as model example, exosomes were isolat…

Fourier transform infrared (ATR-FTIR)Membrane lipidsOmicsExosomes01 natural sciencesExosomeAnalytical Chemistry03 medical and health sciencesstomatognathic systemMETLINSpectroscopy030304 developmental biology0303 health sciencesChemistryProcess Chemistry and TechnologyVesicleHuman milk010401 analytical chemistryExtracellular vesiclesSphingolipidMicrovesicles0104 chemical sciencesComputer Science ApplicationsBiochemistryAttenuated total reflectionLipidomicslipids (amino acids peptides and proteins)UltracentrifugeAttenuated total reflectanceSoftwareChemometrics and Intelligent Laboratory Systems
researchProduct

A numerical approach for the modelling of forming limits in hot incremental forming of AZ31 magnesium alloy

2021

AbstractMagnesium alloys, because of their good specific material strength, can be considered attractive by different industry fields, as the aerospace and the automotive one. However, their use is limited by the poor formability at room temperature. In this research, a numerical approach is proposed in order to determine an analytical expression of material formability in hot incremental forming processes. The numerical model was developed using the commercial software ABAQUS/Explicit. The Johnson-Cook material model was used, and the model was validated through experimental measurements carried out using the ARAMIS system. Different geometries were considered with temperature varying in a…

Fracture forming limit Incremental forming Magnesium alloys Numerical simulation0209 industrial biotechnologyCommercial softwareMaterials sciencebusiness.industryMechanical EngineeringMechanical engineeringForming processes02 engineering and technology021001 nanoscience & nanotechnologyStrength of materialsIndustrial and Manufacturing EngineeringComputer Science Applications020901 industrial engineering & automationControl and Systems EngineeringRange (statistics)Fracture (geology)FormabilityMagnesium alloy0210 nano-technologyAerospacebusinessSettore ING-IND/16 - Tecnologie E Sistemi Di LavorazioneSoftwareThe International Journal of Advanced Manufacturing Technology
researchProduct

Inter-Element Crack Propagation with High-Order Stress Equilibrium Element

2021

The present contribution proposes a formulation based on the use of hybrid equilibrium elements (HEEs), for the analysis of inter-element delamination and fracture propagation problems. HEEs are defined in terms of quadratic stress fields, which strongly verify both the homogeneous and inter-element equilibrium equations and they are employed with interfaces, initially exhibiting rigid behavior, embedded at the elements’ sides. The interface model is formulated in terms of the same degrees of freedom of the HEE, without any additional burden. The cohesive zone model (CZM) of the extrinsic interface is rigorously developed in the damage mechanics framework, with perfect adhesion at the pre-…

FractureModeling and Simulationhybrid equilibriumextrinsic interfaceSettore ICAR/08 - Scienza Delle CostruzioniSettore ING-IND/04 - Costruzioni E Strutture AerospazialiComputer Science ApplicationsJournal of Multiscale Modelling
researchProduct

A passive stabilization solution for camera embedded onboard small planes

2014

Embedded camera is becoming democratized in personal uses like sport. Thus the need for a stabilized video leads to a development of dedicated stabilized systems. However, in professional uses like video protection, stabilization solutions are not yet common. Moreover such a system needs to fit application specific requirements in term of size, weight, amplitude and frequency response.

Frequency responseAmplitude responsebusiness.industryComputer scienceTerm (time)VibrationAmplitudeVibration measurementElectronic engineeringApplication specificComputer visionArtificial intelligencebusinessSimulation2014 IEEE/AIAA 33rd Digital Avionics Systems Conference (DASC)
researchProduct

Extended fractional-order Jeffreys model of viscoelastic hydraulic cylinder

2020

A novel modeling approach for viscoelastic hydraulic cylinders, with negligible inertial forces, is proposed, based on the extended fractional-order Jeffreys model. Analysis and physical reasoning for the parameter constraints and order of the fractional derivatives are provided. Comparison between the measured and computed frequency response functions and time domain transient response argues in favor of the proposed four-parameter fractional-order model.

Frequency responseMechanical EngineeringMathematical analysisFluid Dynamics (physics.flu-dyn)FOS: Physical sciencesPhysics - Fluid DynamicsSystems and Control (eess.SY)Electrical Engineering and Systems Science - Systems and ControlViscoelasticityComputer Science ApplicationsFractional calculusPhysics::Fluid DynamicsShock absorberHydraulic cylinderControl and Systems EngineeringFictitious forceFOS: Electrical engineering electronic engineering information engineeringTime domainTransient responseInstrumentationInformation SystemsMathematics
researchProduct

A technical note on an experimental device to measure friction coefficient in sheet metal forming

2006

Abstract In the paper the authors present the results of several experimental tests aimed to determine the Coulomb friction coefficient in sheet metal forming operations at the varying of the sheet metal material and for different operative conditions. In particular a few pressure and lubricating conditions have been investigated. In order to develop such experiments a dedicated fixture was designed and set-up starting from the one proposed by Wilson.

Friction coefficientMaterials scienceMetallurgyfrictionMetals and AlloysMeasure (physics)Mechanical engineeringTechnical noteFixtureCoulomb frictionIndustrial and Manufacturing EngineeringFinite element methodComputer Science ApplicationsModeling and Simulationvisual_artCeramics and Compositesvisual_art.visual_art_mediumSheet metalFriction test
researchProduct

Friction stir consolidation of aluminum machining chips

2017

Friction stir consolidation (FSC) is a solid-phase manufacturing process that consolidates metal powder, chips, or scraps into solid blocks via severe plastic deformation and solid state welding. It has the potential to be a more economical and “green” process to recycle metal waste. In this study, solid discs were made from AA6061 aluminum alloy machining chips by FSC. The progression of the process was revealed by analyzing the motion of the tool, consolidating force, power history, and macro/microstructure of discs produced from a series of partial consolidation experiments. A bowl-shaped recrystallized zone in the vertical cross-sections of the disc products was observed and conside…

Frictions stir consolidation0209 industrial biotechnologyMaterials sciencebusiness.product_category02 engineering and technologyWeldingIndustrial and Manufacturing Engineeringlaw.invention020901 industrial engineering & automationMachininglawRecyclingSettore ING-IND/16 - Tecnologie E Sistemi Di LavorazioneFEMDesign of experimentConsolidation (soil)Mechanical EngineeringMetallurgyRotational speedComputer Science Applications1707 Computer Vision and Pattern Recognition021001 nanoscience & nanotechnologyComputer Science ApplicationsCompressive strengthControl and Systems EngineeringMetal powderDie (manufacturing)Severe plastic deformation0210 nano-technologybusinessSoftware
researchProduct