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Bulk water equations

Dj IE, ratio of a crack is held constant but the dimensions approach molecular dimensions, the crack becomes more retentive. At room temperature, gaseous molecules can enter such a crack direcdy and by two-dimensional diffusion processes. The amount of work necessary to remove completely the water from the pores of an artificial 2eohte can be as high as 400 kj/mol (95.6 kcal/mol). The reason is that the water molecule can make up to six H-bond attachments to the walls of a pore when the pore size is only slightly larger. In comparison, the heat of vaporization of bulk water is 42 kJ /mol (10 kcal/mol), and the heat of desorption of submonolayer water molecules on a plane, soHd substrate is up to 59 kJ/mol (14.1 kcal/mol). The heat of desorption appears as a exponential in the equation correlating desorption rate and temperature (see Molecularsieves). [Pg.369]

Anion-free water determined by using a chloride ion electrode agrees well with data given in the literature. (2) A new equation has been proposed for the bound water calculation. (3) The mobility of the anion-free water was found to be affected by pressure, porosity and electrolyte concentration. (4) Compaction experiments indicated that the anion-free water will not move until all the bulk water has been removed. (5) It is possible to increase the ratio of bound water to bulk water in a sample through compaction experiment. [Pg.605]

The longitudinal inner-sphere relaxation rate, l/Ti, of bulk water protons is given by Equation (2) 13... [Pg.845]

Equations (2.23) and (2.25), for ra, are interesting because they relate the 0-order reaction in the biofilm to the substrate conditions in the bulk water phase. As seen from these two equations, a fully penetrated biofilm is of 0-order with respect to the bulk water phase, and a partly penetrated biofilm is of... [Pg.32]

The equation for determination of the sulfide produced in terms of the resulting concentration in the bulk water phase based on the areal sulfide production rate is ... [Pg.140]

Aerobic growth in bulk water -1 iyHw 1 (1 - YHw) YHw Equation a... [Pg.163]

The example illustrates how the flow conditions of a sewer pipe affect the reaeration and the resulting DO concentration in the wastewater. As an example, a gravity sewer with a pipe diameter of 500 mm and a slope s=0.003 m nr1 is selected. The sewer is without deposits but with a biofilm on the wetted perimeter. The DO consumption rate of the bulk water phase, rw, is at 10°C assumed to have a maximum value equal to 5 g02 nr3 h 1, however, is limited by the magnitude of the reaeration. The DO consumption rate of the biofilm, rf, is considered a 1-order process in the DO concentration by following Equation (5.12). [Pg.209]

The linear relationship between H NMR transverse relaxation rate and (1 av) is shown in Figure 30 for pregelled potato starch (Hills et al., 1999). The change in slope at about 0.90 c/w corresponds to the bulk water break (i.e., the removal of bulk water) in a corresponding adsorption isotherm. Equation... [Pg.62]

Equation (6.20) determines the maximum degree of swelling and the maximum pore radius of a liquid-equilibrated membrane. This relation suggests that the external gas pressure over the bulk water phase, which is in direct contact with the membrane, controls membrane swelling. The observa-hon of different water uptake by vapor-equilibrated and by liquid water-equilibrated PEMs, denoted as Schroeder s paradox, is thus not paradoxical because an obvious disparity in the external conditions that control water uptake and swelling lies at its root cause. [Pg.379]

In a classical paper. Swift and Connick (34,35) derived solutions of the equation for transverse relaxation, I/T2, and chemical shift, Am, in the case of dilute solutions of paramagnetic ions. Equation (9) gives the increase in transverse relaxation of the bulk water signal, l/72r, due to exchange with water bound to a paramagnetic ion and normalized by the mole fraction of bound water. Pm. [Pg.336]

The Menger-Portnoy model is closely related to the Berezin model employing partition coefficients instead of equilibrium constants.For the case where only two pseudophases (bulk water and micelle) are considered, the partitioning of the reactant is given by the partition coefficient P. This leads to Equation (4) describing observed rate constants as a function of surfactant concentration. [Pg.12]

Both the Menger-Portnoy model and the model by Berezin were effectively derived on the assumption that micellar solutions contain two pseudophases, namely the micellar pseudophase and bulk water. However, both models can be expanded to take more than one micellar pseudophase into account. For example, this could be done when the micellar pseudophase is seen to consist of two separate pseudophases (zones) itself, namely a pseudophase corresponding to the hydrophobic core and a pseudophase corresponding to the micellar Stern region. " If one then assumes a reaction to occur with a rate constant k in the Stern region while the reaction does not occur in the micellar core, the expression for k includes the distribution of the reactant over different zones [Equation (6)]. " ... [Pg.13]

By inspecting Figure 15.9 again, the equation is easily verified. For the surface charge density -0.1 C/uF, the first term on the r.h.s. is around 2800 for water at room temperature and the surface concentration becomes that value plus the total ion concentration in the bulk water phase, i.e., 500H-500mol/m, for the 500mM solution. [Pg.435]

Taking the dielectric constant of water to be about 80, its bulk value, Equation (12) permits the field strength to be estimated ... [Pg.507]

In a theoretical model, we considered the dynamics of bound water molecules and when they become free by translational and rotational motions. Two coupled reaction-diffusion equations were solved. The two rate constants, kbf and kjb, were introduced to describe the transition from bound (to the surface) to free (from the surface) and the reverse, respectively. We also took into account the effect of the bulk water re-entry into the layer—a feedback mechanism—and the role of orientational order and surface inhomogeneity on the observed decay characteristics. With this in mind, the expressions for the change in density with time were written defining the feedback as follows ... [Pg.15]

Coalescer sizing. The general sizing equation for plate coalescers with flow parallel to or perpendicular to the direction of bulk water flow is ... [Pg.172]

Since the presentation of this model new data have appeared which allow various tests and new conclusions. The diffusion coefficients of Karger (14), together with Equation 1 and the median jump time from the relaxation data at room temperature yield a jump distance of 2.7 A for the zeolitic water as compared with 2.2 A in bulk water (see Table III for a data summary). One might be tempted to explain the jump distance in terms of some geometrical constant of the zeolite structure such as the distance between Sn and Sm ionic sites (40), but with the cages full of... [Pg.424]

The water molecule hydrogen-bonded to the hydrogen atom of the hydroxide group is assumed not to differ from bulk water in fractionation behaviour, and may therefore be omitted.) The modification of equation (34) corresponding to (133) is therefore... [Pg.307]

Figure 3.26 Schematic representation of a five-zone dielectric continuum model used to calculate As for hole transfer between guanine sites (zone 1 (the solute )) in an aqueous DNA duplex [23]. The other zones refer, respectively, to other nucleobases of the DNA tt stack (zone 2) sugar-phosphate backbone (zone 3) bound water within 3 A of the surface of the DNA (zone 4) and bulk water (zone 5). The + and — charges are the simplest possible model for the net charge density change (Ap) involved in As (see Equation (3.89)). In the actual detailed calculations (see text and Equation (3.95)) multiple point-charge D and A sites were employed (figure drawn by Dr. K. Siriwong, private communication). Figure 3.26 Schematic representation of a five-zone dielectric continuum model used to calculate As for hole transfer between guanine sites (zone 1 (the solute )) in an aqueous DNA duplex [23]. The other zones refer, respectively, to other nucleobases of the DNA tt stack (zone 2) sugar-phosphate backbone (zone 3) bound water within 3 A of the surface of the DNA (zone 4) and bulk water (zone 5). The + and — charges are the simplest possible model for the net charge density change (Ap) involved in As (see Equation (3.89)). In the actual detailed calculations (see text and Equation (3.95)) multiple point-charge D and A sites were employed (figure drawn by Dr. K. Siriwong, private communication).
Figure 3.31 As (due to orientational response of aqueous solvent) versus e, calculated for ET in a large binuclear transition metal complex (D (Ru2+/3+) and A (Co2+/3+) sites bridged by a tetraproline moiety) molecular-level results obtained from a nonlocal polarization response theory (NRFT, solid lines) continuum results are given by dashed lines, referring to numerical solution of the Poisson equation with vdW (cont./vdW) and SAS (cont./SAS) cavities, or as the limit of the NRFT results when the full k-dependent structure factor (5(k)) is replaced by 5(0) 5(k) for bulk water was obtained from a fluid model based on polarizable dipolar spheres (s = 1.8 refers to ambient water (square)). For an alternative model based on TIP3 water (where, nominally, 6 = ), ambient water corresponds to the diamond. (Reprinted from A. A. Milishuk and D. V. Matyushov, Chem Phys., 324, 172. Copyright (2006), with permission from Elsevier). Figure 3.31 As (due to orientational response of aqueous solvent) versus e, calculated for ET in a large binuclear transition metal complex (D (Ru2+/3+) and A (Co2+/3+) sites bridged by a tetraproline moiety) molecular-level results obtained from a nonlocal polarization response theory (NRFT, solid lines) continuum results are given by dashed lines, referring to numerical solution of the Poisson equation with vdW (cont./vdW) and SAS (cont./SAS) cavities, or as the limit of the NRFT results when the full k-dependent structure factor (5(k)) is replaced by 5(0) 5(k) for bulk water was obtained from a fluid model based on polarizable dipolar spheres (s = 1.8 refers to ambient water (square)). For an alternative model based on TIP3 water (where, nominally, 6 = ), ambient water corresponds to the diamond. (Reprinted from A. A. Milishuk and D. V. Matyushov, Chem Phys., 324, 172. Copyright (2006), with permission from Elsevier).

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See also in sourсe #XX -- [ Pg.91 , Pg.92 ]




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