Search results for "surface"
showing 10 items of 9345 documents
Polymers films with indandione derivatives as alternatives to azobenzene polymers for optical patterning
2008
Surface relief gratings (SRGs) on organic thin films are studied extensively for both scientific interest and in relevance to the applications. Among the chromophores being used the azobenzenes showed the best performance, but the use of alternative photo-sensitive groups provides better general understanding of the phenomena. A thermodynamic theory and molecular dynamics simulations of photoinduced effects are discussed. In this study we use indandione derivatives, known as promising materials for photonics applications, as an alternative to the azobenzenes. We consider their photoreactions when incorporated into a polymer film. One of interesting features is the spectral dependence of the…
TI: Cyclophosphazenes as polymer modifiers
2003
The utilization of cyclophosphazenes as polymer modifiers is reviewed, with particular concern to their exploitation as versatile chain extenders, possibly for recycle problems, crosslinkers, to enhance mechanical properties of polymeric materials, branchers, to selectively introduce ramifications in linear polymers, and compatibilizers, to favor the formation of blends between originally incompatible organic macromolecules. The great versatility of the synthetic methods put forward for these substrates, together with the ease of controlling their modification, functionalization and reactivity are important parameters for the evaluation of which type of use is more feasible for these trimer…
Microwave synthesis of core-shell structured biocompatible magnetic nanohybrids in aqueous medium
2011
In the past decade, biocompatible magnetic nanohybrids, i.e. materials consisting of an inorganic core encapsulated by a biocompatible polymeric corona, went throw various developments in biomedical applications especially in the fields of diagnosis and therapy. Numerous descriptions of their syntheses can be found in the literature (Zhang et al., 2002; Flesch et al., 2004; Fan et al., 2007; etc). These two-steps protocols often describe the use of organic or aqueous solvents, classical thermal heating, long time reaction as well as fastidious exchange and drying steps. In recent years, microwave heating has been proven to be a very original technology for nanoparticles synthesis due to its…
Growth Mechanism and Surface Functionalization of Metal Chalcogenides Nanostructures
2014
Following the discovery of carbon fullerenes and nanotubes (NTs), nanostructured materials and their synthesis have attracted tremendous attention due to their superior mechanical properties, their unique electronic behavior, and their high potential in making technologically advanced nanodevices. Among different classes, layered metal chalcogenides nanostructures are of interest for a variety of applications ranging from nanoelectronics or as source materials for energy applications, nanotribology and in heterogeneous catalysis. These nanoparticles are metastable phases. Therefore, equilibrium methods are necessary to prevent the formation of the thermodynamically stable bulk phase. On the…
Defect-Free Chemical Functionalization of Magnetic Monolayers Based on Coordination Polymers
2018
<p>Chemical functionalization has demonstrated to be a powerful approach to tailor the physical and chemical properties of two-dimensional (2D) materials, to increase their processability and</p> <p>stability, to add new functionalities and, even, to create new 2D materials. However, this post synthetic method – which involves the anchoring of molecules on the surface of an exfoliated 2D crystal – inevitably leads to defective materials, which lack long-range structural order. If defect-free functionalized monolayers are required, a radically new approach needs to be developed. Here we present a pre-synthetic method based on coordination chemistry that affords the isolatio…
Liquid crystal polymers (LCP) as processing aids and reinforcing agents. A study of nylon 6/LCP blends
1989
Influence de petites quantites d'un copolyesteramide thermotropique sur les proprietes mecaniques et la mise en œuvre du polyamide 6
Reactions of Peroxides on Solid Surfaces
2014
This article describes the different roles that solid surfaces play in heterogeneous reactions involving peroxides, namely, (i) the solid surface interacts with the peroxide in the absence of any other substrate, (ii) the solid surface promotes the reaction activating either the peroxide or the substrate, (iii) the peroxide forms part of the solid active surface, and (iv) the substrate forms part of the active surface. The chapter covers reactions involving peroxides or discrete peroxydic transient species on solid surfaces or at solid–liquid and solid–gas interfaces, and provides general descriptions of different solid materials, details on reaction conditions, and synthetic procedures for…
Theoretical Study of the Elimination Kinetics of Carboxylic Acid Derivatives in the Gas Phase. Decomposition of 2-Chloropropionic Acid
1997
The reaction mechanism for the decomposition of 2-chloropropionic acid in the gas phase to form hydrogen chloride, carbon monoxide, and acetaldehyde has been theoretically characterized. Analytical gradients have been used by means of AM1 and PM3 semiempirical procedures and ab initio methods at HF and DFT (BLYP) levels with the 6-31G** basis set. The correlation effects were also included by using the perturbational approach at the MP2 level with the 6-31G** and 6-31++G** basis sets and the variational approach at the CISD/6-31G** level and by means of MCSCF wave functions with a (6,6) complete active space and the 6-31G** basis set. The global potential energy surface has been studied, an…
Reversible, room-temperature C—C bond activation of benzene by an isolable metal complex
2019
The activation of C-C bonds is of fundamental interest in the construction of complex molecules from petrochemical feedstocks. In the case of the archetypal aromatic hydrocarbon benzene, C-C cleavage is thermodynamically disfavored, and is brought about only by transient highly reactive species generated in situ. Here we show that the oxidative addition of the C-C bond in benzene by an isolated metal complex is not only possible, but occurs at room temperature and reversibly at a single aluminium center in [(NON)Al]- (where NON = 4,5-bis(2,6-diisopropylanilido)-2,7-di-tert-butyl-9,9-dimethylxanthene). Selectivity over C-H bond activation is achieved kinetically and allows for the generation…
Advanced descriptors for long-range noncovalent interactions between SARS-CoV-2 spikes and polymer surfaces.
2021
The recent pandemic triggered numerous societal efforts aimed to control and limit the spread of SARS-CoV-2. One of these aspects is related on how the virion interacts with inanimate surfaces, which might be the source of secondary infection. Although recent works address the adsorption of the spike protein on surfaces, there is no information concerning the long-range interactions between spike and surfaces, experimented by the virion when is dispersed in the droplet before its possible adsorption. Some descriptors, namely the interaction potentials per single protein and global potentials, were calculated in this work. These descriptors, evaluated for the closed and open states of the sp…