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Cavity generation

The simplest shape for the cavity is a sphere or possibly an ellipsoid. This has the advantage that the electrostatic interaction between M and the dielectric medium may be calculated analytically. More realistic models employ moleculai shaped cavities, generated for example by interlocking spheres located on each nuclei. Taking the atomic radius as a suitable factor (typical value is 1.2) times a van der Waals radius defines a van der Waals surface. Such a surface may have small pockets where no solvent molecules can enter, and a more appropriate descriptor may be defined as the surface traced out by a spherical particle of a given radius rolling on the van der Waals surface. This is denoted the Solvent Accessible Surface (SAS) and illustrated in Figm e 16.7. [Pg.393]

If the power dissipated into the system is increased, although the collapse pressure, as predicted using bubble dynamics analysis [14], decreases with an increase in the intensity, the number of cavitation events also increases (increase is substantial as compared to the negative effect of decreasing collapse pressure) thereby increasing the overall cavitational activity and hence enhanced effects can be observed. Usually the increase in number of cavities generated seizes after a... [Pg.52]

Sonication, the application of high-intensity ultrasound at frequencies beyond the range of human hearing (16 kHz), of a monomer results in radical polymerization. Initiation results from the effects of cavitation—the formation and collapse of cavities in the liquid. The collapse (implosion) of the cavities generates very high local temperatures and pressures. This results in the formation of excited states that leads to bond breakage and the formation of... [Pg.227]

Figure 3 Schematic representation of the formation of inclusion complexes based on the recognition of a guest molecule by a host receptor (a), of a clathrate based on the inclusion of guest molecules within cavities generated upon packing of clathrands in the solid state (b), and of a 1-D inclusion molecular network named koilate formed through interconnection of hollow tectons (koilands) by connector molecules (c). Figure 3 Schematic representation of the formation of inclusion complexes based on the recognition of a guest molecule by a host receptor (a), of a clathrate based on the inclusion of guest molecules within cavities generated upon packing of clathrands in the solid state (b), and of a 1-D inclusion molecular network named koilate formed through interconnection of hollow tectons (koilands) by connector molecules (c).
Dependence of reactivity on water penetration into contraction cavity generated in the core center... [Pg.186]

The information on pore size cannot always be directly correlated to the macroscopic measurements obtained by mercury porosity because the definition of a pore is different. In porosimetry, pore entrance sizes are measured, the volume of the cavity to which it gives access is attributed to the diameter of the entrance whilst, in a cross-section or fracture of the same carrier, all the cavities generated by the assembly of particles are viewed. [Pg.148]

The aim of the designer of the equipment should be to maximize both these quantities by suitable adjustment of the different parameters, including the methodology used for the generation of cavities (the type of cavity generated is a crucial parameter in deciding the intensity of the cavitation phenomena). [Pg.239]

The same methodology was used to generate an immobilized chiral rhodium(lll) complex, which catalyzes the asymmetric reduction of benzophenone with significantly higher activity than a control polymer without a cavity. Excellent enantioselectivities were obtained (up to 95% ee vs. 2-9% ee for the control polymer). Competitive experiments with acetophenone and a second co-substrate have revealed that the cavity generated with the phosphinato ligand is specific for acetophenone. [Pg.809]

The flattening of the pyramidal cavities generated by selected capping vertices in hypoelectronic indium polyhedra with 10 and 11 vertices relates to the location of the... [Pg.401]

Besides the well-confined and rigid framework of zeolites, cation species also plays an important role in manipulating photochemical reaction occurring in the cavity. The free volume in zeolile cavity relies on the number and sort of cations located in the cavity. Differing from isotropic media, in which the direction and magnitude of electric field fluctuate around a solvated molecule, cations in zeoUte cavity generate a stronger, anisotropic and more stable electric field. Such an electric field can polarize the included... [Pg.22]

Clathrates of tetraphenylene 6 form a single isostruc-tural series (P42/n) with H G ratio 2 1, in which guests range in size from dichloromethane to cyclohexane. Guests occupy common spheroidal cavities generated by the isostructural host framework. Elaboration of the host 6 to the more buUqf tetrabenzo[ ,/z, ,t]tetraphenylene 4 produce, no fewer than three distinct isostructural series of clathrates (two triclinic, one monoclinic). [Pg.771]

For the preparation of nano- and microgels, reactive monomers and macro-monomers are loaded into nano- and microreactors, which are usually emulsion droplets [23] or cavities generated by soft lithography [24]. After cross-linking the macromonomers inside of these nano- and microtemplates... [Pg.254]

This expression can be generalized [54] by expanding the dipole in a multipole series (usually up to the sixth term) and by describing the cavity generated by the solute as an ellipsoid of axes a, b, and c (Figure 2.2c) ... [Pg.45]


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See also in sourсe #XX -- [ Pg.170 ]




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