Search results for "Chemical engineering"

showing 10 items of 5892 documents

Solute-induced Water Structure: Computer Simulation on a Model System

1988

Abstract Two series of Monte Carlo simulations have been carried out on a system consisting of 125 water molecules, one of which is kept fixed to simulate a water molecule whose mobility is restricted by a solute. The results are checked against similar simulations without restrictions, used as a control, and they show how the blocked molecule helps increase both the structural order and the connectivity of the hydrogen bond network. Cooperativity originating from proton polarizability of H-bonds and/or from many-body terms of interaction potentials cannot be involved since we use a rigid water model and ab initio pair potentials. The present findings are interpreted as indicative of a moti…

ChemistryHydrogen bondGeneral Chemical EngineeringMonte Carlo methodAb initioCooperativityGeneral ChemistryCondensed Matter PhysicsChemical physicsComputational chemistryPolarizabilityModeling and SimulationWater modelDynamic Monte Carlo methodMoleculeGeneral Materials ScienceInformation SystemsMolecular Simulation
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Naturally occurring polyphenols as building blocks for supramolecular liquid crystals – substitution pattern dominates mesomorphism

2021

A modular supramolecular approach towards hydrogen-bonded liquid crystalline assemblies based on naturally occurring polyphenols is reported. The combination of experimental observations, crystallographic studies and semi-empirical analyses of the assemblies provides insight into the structure–property relationships of these materials. Here a direct correlation of the number of donor OH-groups as well as their orientation with the mesomorphic behavior is reported. We discovered that the number and orientation of the OH-groups have a stronger influence on the mesomorphic behavior of the supramolecular assemblies than the connectivity (e.g. stilbenoid or chalconoid) of the hydrogen bond donor…

ChemistryHydrogen bondLiquid crystallineProcess Chemistry and TechnologyChemieBiomedical EngineeringSupramolecular chemistryEnergy Engineering and Power Technology02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnology01 natural sciencesIndustrial and Manufacturing Engineering0104 chemical sciencesCrystallographyChemistry (miscellaneous)Liquid crystalSupramolecular Chemistry Liquid Crystals Crystal Engineering Hydrogen BondingMaterials ChemistryChemical Engineering (miscellaneous)Settore CHIM/07 - Fondamenti Chimici Delle Tecnologie0210 nano-technologyMolecular Systems Design & Engineering
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Current Developments in Industrial Fermentation Processes

2021

ChemistryIndustrial fermentationBiochemical engineeringCurrent (fluid)Fermentation Processes
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Synthesis, characterization, and hierarchical organization of tungsten oxide nanorods: spreading driven by Marangoni flow.

2009

Tungsten oxide nanorods were synthesized by a soft chemistry approach using tungsten alkoxide and trioctyl amine and oleic acid as the surfactants. The optical properties of the nanorods were studied. The nanorods were found to be soluble in a wide range of solvents like chloroform, cyclohexane, and so on. Upon solvent evaporation, the nanorods formed hierarchically organized solid state structures. Depending on the solvent used, the nanorods organized in different mesostructures. Moreover, the organization of the nanorods from mixtures of polar and nonpolar solvents was studied. Here, the Marangoni effect resulting from differences in the surface tensions of the two solvents was found to p…

ChemistryInorganic chemistrychemistry.chemical_elementGeneral ChemistryTungstenElectrochromic devicesBiochemistryDip-coatingCatalysisSoft chemistrySolventchemistry.chemical_compoundColloid and Surface ChemistryChemical engineeringAlkoxideNanorodThin filmJournal of the American Chemical Society
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Evaluation of the Stability of Pure Silica MCM-41 toward Water Vapor

1999

Water vapor adsorption/desorption isotherms at 298 K and XRD measurements and nitrogen isotherms at 77 K before and after exposure to water vapor were determined on pure silica MCM-41 samples; samples had different pore widths and were prepared by different synthesis methods, including hydrothermal and room-temperature procedures. It was found that prolonged exposure to water vapor provoked structural alterations in all of the MCM-41 materials studied, the most significant effects being a loss of pore shape uniformity and a large decrease in pore size and, in consequence, pore volume. Analysis of the results suggests that these alterations are due to expansion of the pore walls as well as, …

ChemistryInorganic chemistrytechnology industry and agriculturechemistry.chemical_elementSurfaces and InterfacesCondensed Matter PhysicsMolecular sieveNitrogenHydrothermal circulationAdsorptionMCM-41Volume (thermodynamics)Chemical engineeringDesorptionElectrochemistryGeneral Materials ScienceSpectroscopyWater vaporLangmuir
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Application of solid-state electrochemistry techniques to polyfunctional organic–inorganic hybrid materials: The Maya Blue problem

2013

Abstract The time evolution of indigo plus palygorskite powdered mixtures during isothermal heating at different temperatures between 120 and 180 °C to form Maya Blue-type materials has been monitored by means of infrared spectrometry, diffuse reflectance spectrometry in the visible region and solid state electrochemical techniques. The kinetics of the formation process of such materials can be described in terms of two consecutive reactions, the first one consisting of the loss of zeolitic water of the palygorskite coupled with clay-indigo attachment and partial indigo to denydroindigo oxidation. The palygorskite dehydration acts as a rate-determining step fitting to a 3D Avrami-Erofe’ev k…

ChemistryKineticsInfrared spectroscopyPalygorskiteGeneral ChemistryCondensed Matter PhysicsElectrochemistryIndigoIsothermal processChemical engineeringMechanics of MaterialsmedicineOrganic chemistryGeneral Materials ScienceDiffuse reflectionHybrid materialmedicine.drugMicroporous and Mesoporous Materials
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Nonlinear hairy layer theory of electrophoretic fingerprinting applied to consecutive layer by layer polyelectrolyte adsorption onto charged polystyr…

1997

The consecutive layer-by-layer adsorption of poly(allylamine hydrochloride) (PAH) and poly(styrenesulfonate) (PSS) on colloidal charged latex particles is investigated by measuring the electrophoretic mobility as a function of pH and ionic strength over a broad range (electrophoretic fingerprinting). Meaningful interpretation of the data required the development of a nonlinear approach to hairy particle electrophoresis including dissociation, adsorption, and association. Steric and electrostatic exclusion of mobile ions from the hairy layer has been considered. Also, the surface conductivity correction is extended to the case of charged hairy layer particles. We deposited up to three polyel…

ChemistryLayer by layerSurfaces and InterfacesCondensed Matter PhysicsPolyelectrolyteSurface conductivityColloidElectrophoresisAdsorptionPolyelectrolyte adsorptionChemical engineeringIonic strengthPolymer chemistryElectrochemistryGeneral Materials ScienceSpectroscopy
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A 4-tert-butylcalix[4]arene tetrahydroxamate podand based on the 1-oxypiperidine-2-one (1,2-PIPO−) chelate. Self-assembly into a supramolecular ionop…

2014

An octadentate tetrahydroxamic calix[4]arene podand incorporating 1-hydroxypiperidine-2-one (1,2-PIPOH) binding units has been designed as a specific chelator for tetravalent metal cations like Zr4+ or Hf4+. This receptor, which can be considered as the first ever abiotic ligand possessing only cyclic six-membered hydroxamate groups, has been synthesized and characterized in its tetraprotonated form (1H4). Contrary to expectation, however, this new chelator did not form a 1 : 1 complex upon reaction with M(acac)4 (M = Zr and Hf; acac = acetylacetonate), but rather self-assembled into a dimeric species of 2 : 2 stoichiometry. The latter could be characterized in solution by mass spectrometry…

ChemistryLigandStereochemistryGeneral Chemical EngineeringSupramolecular chemistryIonophoreGeneral ChemistryNuclear magnetic resonance spectroscopyAdductMetalvisual_artPolymer chemistryvisual_art.visual_art_mediumChelationStoichiometryRSC Adv.
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Room Temperature Magnetism in Layered Double Hydroxides due to Magnetic Nanoparticles

2013

Some recent reports claiming room temperature spontaneous magnetization in layered double hydroxides (LDHs) have been published; however, the reported materials cause serious concern as to whether this cooperative magnetic behavior comes from extrinsic sources, such as spinel iron oxide nanoparticles. The syntheses of crystalline Fe(3+)-based LDHs with and without impurities have been developed, highlighting the care that must be taken during the synthetic process in order to avoid misidentification of magnetic LDHs.

ChemistryMagnetismSpinelLayered double hydroxidesNanotechnology02 engineering and technologyengineering.material010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical sciencesInorganic Chemistrychemistry.chemical_compoundChemical engineeringImpurityengineeringMagnetic nanoparticlesPhysical and Theoretical Chemistry0210 nano-technologySpontaneous magnetizationIron oxide nanoparticlesInorganic Chemistry
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Electroanalytical techniques in archaeological and art conservation

2017

[EN] The application of electrochemical techniques for obtaining analytical information of interest in the fields of archaeometry, conservation and restoration of cultural heritage goods is reviewed. Focused on voltammetry of immobilised particles and electrochemical impedance spectroscopy techniques, electrochemical measurements offer valuable information for identifying and quantifying components, tracing provenances and manufacturing techniques and provide new tools for authentication and dating.

ChemistryManagement scienceGeneral Chemical EngineeringArt conservationAnalytical Chemistry (journal)02 engineering and technologyGeneral Chemistry010402 general chemistry021001 nanoscience & nanotechnology01 natural sciences0104 chemical sciencesConservationChemCultHeritArchaeologyPINTURAElectrochemistry0210 nano-technologyAnalytical chemistry
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