0000000001248033

AUTHOR

Vanessa Firetto

showing 15 related works from this author

Effect of chain stiffness on the phase behavior of model polymer and surfactant solutions by GCMC simulations

2004

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Model Random Copolymer Solutions by Monte Carlo simulations

2007

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Effect of stiffness on the phase behavior of cubic lattice chains

2005

Gran canonica Monte Carlo (GCMC) simulazioni assistite da tecniche di riponderazione istogramma sono stati utilizzati per studiare l'effetto della flessibilità catena sul comportamento di soluzione fase di cubi catene reticolari corti con 4-32 segmenti. Ciò è stato fatto variando un parametro di rigidità gradualmente fino alla media calcolata end-to-end distanza avvicinato la lunghezza totale. Per entrambe le catene flessibili e rigide si è riscontrato che la temperatura critica, ottenuta tramite mista analisi dei campi di dimensioni finite, aumentata lunghezza della catena e la densità critica trasferisce a valori più bassi, in accordo con le osservazioni sperimentali. Il estrapolato lungh…

COEXISTENCE-CURVEPolymers and PlasticsEQUILIBRIAThermodynamicsEndothermic processRodInorganic ChemistryMOLECULESPhase (matter)Materials ChemistrymedicineStatistical physicsPhase diagramchemistry.chemical_classificationINTERFACIAL-TENSIONOrganic ChemistryIntermolecular forceStiffnessMIXTURESPolymerSEPARATED POLYMER-SOLUTIONSEQUATION-OF-STATESolution phaseFLUIDchemistryCRITICAL-POINTmedicine.symptomMONTE-CARLO SIMULATIONS
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Copolymerization of Vinylidene Fluoride and Acrylic Acid in Supercritical Carbon Dioxide

2010

The free-radical copolymerization of vinylidene fluoride (VDF) and acrylic acid (AA) was carried out in supercritical carbon dioxide using both precipitation and dispersion techniques in the presence of an ammonium carboxylate perfluoropolyether compound. Formation of a copolymer was confirmed by variable contact time CP MAS NMR spectroscopy. Macromolecular matrices were significantly enriched in AA with respect to the initial feed composition and we found that the nonfluorinated monomer has a much higher reactivity ratio with respect to VDF. The cumulative concentration, crystallinity, and water affinity of the synthesized copolymers could be modified changing the initial feed composition,…

copolymerizationsupercritical fluidacrylic acidfluoropolymervinylidene fluorideSettore ING-IND/27 - Chimica Industriale E Tecnologicamembraneradical polymerizationfreeradical copolymerization
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Studi computazionali su fenomeni di auto-aggregazione di copolimeri-modello in soluzione

2006

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Monte Carlo simulations of aggregation phenomena in model polymer and surfactant solutions

2005

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Computer Simulations Study of the Phase Behavior of Polymer and Surfactant Solutions: from Flexible to Rigid Chains

2005

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Effect of Stiffness on the Micellization Behavior of Model H4T4 Surfactant Chains

2006

The micellization behavior of a series of model surfactants, all with four head and tail groups (H4T4) but with different degrees of chain stiffness, was studied using grand canonical Monte Carlo simulations on a cubic lattice. The critical micelle concentration, micellar size, and thermodynamics of micellization were examined. In all cases investigated, the critical micelle concentration was found to increase with increasing temperature as observed for nonionic surfactants in apolar or slightly polar solvents. At a fixed reduced temperature and increasing chain stiffness, in agreement with previous observations, it was found that the critical micelle concentration decreased and the average…

Aggregation numberChemistryCrystal lattices Hydrophobicity Micelles Molecular structure Monte Carlo methods SolventsThermodynamics of micellizationMonte Carlo methodtechnology industry and agricultureThermodynamicsSurfaces and InterfacesCondensed Matter PhysicsMicelleSurface-Active AgentsReduced propertiesPulmonary surfactantCritical micelle concentrationElectrochemistryThermodynamicsOrganic chemistryPolarGeneral Materials ScienceMonte Carlo MethodMicellesSpectroscopySettore CHIM/02 - Chimica FisicaLangmuir
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Aggregation behavior of tethered POSS nanocubes by Monte Carlo simulations

2007

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Free radical copolymerization of vinylidene fluoride and acrylic acid in supercritical carbon dioxide

2010

Supercritical carbon dioxide acrylic acid copolymers free radical polymerizationSettore ING-IND/27 - Chimica Industriale E Tecnologica
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Studio computazionale di materiali nanostrutturati POSS

2006

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Copolymerization of vinylidene fluoride and acrylic acid in supercritical carbon dioxide

2009

The free-radical copolymerization of vinylidene fluoride (VDF) and acrylic acid (AA) was carried out in supercritical carbon dioxide using both precipitation and dispersion techniques in the presence of an ammonium carboxylate perfluoropolyether compound. Formation of a copolymer was confirmed by variable contact time CP MAS NMR spectroscopy. Macromolecular matrices were significantly enriched in AA with respect to the initial feed composition and we found that the nonfluorinated monomer has a much higher reactivity ratio with respect to VDF. The cumulative concentration, crystallinity, and water affinity of the synthesized copolymers could be modified changing the initial feed composition,…

Dispersion polymerizationSupercritical carbon dioxidePolymers and PlasticsOrganic ChemistryRadical polymerizationSupercritical fluidchemistry.chemical_compoundMonomerchemistryPolymerizationChemical engineeringPolymer chemistryMaterials ChemistryCopolymerAcrylic acidJournal of Polymer Science Part A: Polymer Chemistry
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Preparation of pH sensitive poly(vinilydenefluoride) porous membranes by grafting of acrylic acid assisted by supercritical carbon dioxide

2010

Aim of this work is to study the preparation of pH sensitive membranes for biomedical applications via thermal induced graft polymerization of acrylic acid (AA) on poly(vinilydenefluoride) (PVDF) assisted by supercritical carbon dioxide (scCO2). Using scCO2 as a solvent and swelling agent, the monomer and initiator (benzoyl peroxide) could diffuse faster and distribute more uniformly into the polymer matrix. A better control of the final molecular architecture should be achieved because bimolecular grafting reactions are accelerated with respect to chain degradation processes. Commercial hydrophobic PVDF porous matrixes were selected as model membranes. Grafted polymers were characterized b…

supercritical carbon dioxide poly(vinilydenefluoride) pH sensitive
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Effect of chain stiffness on the phase behavior of model polymer and surfactant solutions by GCMC simulations

2004

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Computational studies of POSS - based materials

2006

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