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Ideally, a mathematical model would link yields and/or product properties with process variables in terms of fundamental process phenomena only. All model parameters would be taken from existing theories and there would be no need for adjusting parameters. Such models would be the most powerful at extrapolating results from small scale to a full process scale. The models with which we deal in practice do never reflect all the microscopic details of all phenomena composing the process. Therefore, experimental correlations for model parameters are used and/or parameters are evaluated by fitting the calculated process performance to that observed. [Pg.232]

In this expression a common residual variance term is specified, although the residual variance can be indexed to the model, in which case the overall residual variance will be the sum of the contribution of the residual variance for each of the m candidate models. It has been found that chain mixing occurs faster when competing models are linked with a common parameter (e.g., the residual error) (42). It is common in the non-Bayesian model framework to address model selection as a... [Pg.158]

The backbone of the climate forecast, of course, is the operational model that links the short-term El Nino scale to the longer term. The observing system is the key challenge for testing the veracity of calculations. Carbon sources and sinks have been discussed. I believe that upper ocean observations, climate data records at the surface, and benchmark observation that establish the long-term evolution of the climate in an absolute sense constitute the centerpiece of what must be done. [Pg.87]

This includes the Pauli repulsion and (attractive) dispersion terms. The polarizability of the ions is included using the shell model (Dick and Overhauser, 1964) which, as discussed in Chapter 3, models the polarizability using a massive core linked to a mass-less shell by a spring. The theoretical basis of this model is uncertain, but its practical success has been attested over 20 years. Probably the best way to consider it is as a sensible model for linking the electronic polarizability of the ions to the forces exerted by the surrounding lattice. It is therefore a many-body term, a fact that should be remembered if one wishes to consider three-body potentials in the description of the crystal. A recent development in the field has been the use of quantum calculations. These are discussed in detail elsewhere (Chapter 8) but some results will be compared with the classical simulations in this chapter. [Pg.186]

In multimedia box models, the environmental fate of a chemical is described by a set of coupled mass-balance equations for all boxes of the model. These equations include terms for degradation, inter-media exchange such as settling and resuspension of particles, and transport with air and water flows [19,20]. Equations for different boxes are coupled by inter-media exchange terms (linking different environmental media) and terms for trans-... [Pg.126]

The features from the previous chapter s models, when considered with other factors like customer demand-driven needs, wants, desires, and price point supply side service feeds the effect of the Internet, business strategic solutions and technology options, along with their interrelated and interconnected links, can be drawn into a new topology model termed the Service Value Network Framework Model. [Pg.81]

This paper describes the development of a novel dynamic predictive and optimal control method for the wet end of a papermaking systems. This part of the system plays an important function in the process in terms of its controllability and potential for optimisation. The wet end process is complicated and the control systems are always multivariable and dynamic in nature. Due to the severe interactions between each variable, general physical and chemistry based modelling techniques cannot be established. As such, feed-forward neural networks are selected as a modelling tool so as to build up a number of non-linear models that link all the variables to the concerned quality outputs and process efficiency. [Pg.1067]

A limitation of the freely jointed chain model is that the bond angle 9 linking polymer repeat units is constant (e.g., 9 = 109.5 for tetrahedrally connected carbons), which results in some degree of correlation between repeat unit orientations. A model termed the freely rotating chain model fixes the bond angle between repeat units, but allows free rotation about bonds connecting them (Figure 7.5). In this case, it can be shown that... [Pg.287]

It is somewhat difficult conceptually to explain the recoverable high elasticity of these materials in terms of flexible polymer chains cross-linked into an open network structure as commonly envisaged for conventionally vulcanised rubbers. It is probably better to consider the deformation behaviour on a macro, rather than molecular, scale. One such model would envisage a three-dimensional mesh of polypropylene with elastomeric domains embedded within. On application of a stress both the open network of the hard phase and the elastomeric domains will be capable of deformation. On release of the stress, the cross-linked rubbery domains will try to recover their original shape and hence result in recovery from deformation of the blended object. [Pg.303]

Very recently, people who engage in computer simulation of crystals that contain dislocations have begun attempts to bridge the continuum/atomistic divide, now that extremely powerful computers have become available. It is now possible to model a variety of aspects of dislocation mechanics in terms of the atomic structure of the lattice around dislocations, instead of simply treating them as lines with macroscopic properties (Schiotz et al. 1998, Gumbsch 1998). What this amounts to is linking computational methods across different length scales (Bulatov et al. 1996). We will return to this briefly in Chapter 12. [Pg.50]

Both of the current models for the central mode scattering contain the implicit assumption of cubic symmetry above Tm. Possibly because of the dramatic nature of the soft-mode behaviour and a ready understanding of the structural transformation in terms of it, there was a strong incentive to establish a link between it and the central mode scattering. A consistent difficulty with this approach is the failure to establish an intrinsic line-width for the central mode peak and the unspecified nature of the mechanism responsibly for a low-frequency resonance in the energy of the soft mode. ... [Pg.337]


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