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Solution systems model rules

Richards, et. al. s idea is to use a genetic algorithm to search through a space of a certain class of cellular automata rules for a local rule that best reproduces the observed behavior of the data. Their learning algorithm (which was applied specifically to sequential patterns of dendrites formed by NH4 Br as it solidifies from a supersaturated solution) starts with no a-priori knowledge about the physical system. R, instead, builds increasingly sophisticated models that reproduce the observed behavior. [Pg.591]

All these results support our kinetic interpretations of these supersaturated gelling solutions. We assume that the network growth is described by the growth of individual domains, each one ruled by the autocatalytic model (S). This system behaves like an assembly of microdomains. Sach steroid in a supersaturation state is a potential germ of microdo.main. According to distribution curves of induction times for each microdomain, the typical kinetic curves for each part A and B of the phase diagram are obtained. [Pg.125]

Secondary phases predicted by thermochemical models may not form in weathered ash materials due to kinetic constraints or non-equilibrium conditions. It is therefore incorrect to assume that equilibrium concentrations of elements predicted by geochemical models always represent maximum leachate concentrations that will be generated from the wastes, as stated by Rai et al. (1987a, b 1988) and often repeated by other authors. In weathering systems, kinetic constraints commonly prevent the precipitation of the most stable solid phase for many elements, leading to increasing concentrations of these elements in natural solutions and precipitation of metastable amorphous phases. Over time, the metastable phases convert to thermodynamically stable phases by a process explained by the Guy-Lussac-Ostwald (GLO) step rule, also known as Ostwald ripening (Steefel Van Cappellen 1990). The importance of time (i.e., kinetics) is often overlooked due to a lack of kinetic data for mineral dissolution/... [Pg.650]

As it follows from the above-said, nowadays any study of the autowave processes in chemical systems could be done on the level of the basic models only. As a rule, they do not reproduce real systems, like the Belousov-Zhabotinsky reaction in an implicit way but their solutions allow to study experimentally observed general kinetic phenomena. A choice of models is defined practically uniquely by the mathematical formalism of standard chemical kinetics (Section 2.1), generally accepted and based on the law of mass action, i.e., reaction rates are proportional just to products of reactant concentrations. [Pg.472]

The steps for constructing and interpreting an isothermal, isobaric thermodynamic model for a natural water system are quite simple in principle. The components to be incorporated are identified, and the phases to be included are specified. The components and phases selected "model the real system and must be consistent with pertinent thermodynamic restraints—e.g., the Gibbs phase rule and identification of the maximum number of unknown activities with the number of independent relationships which describe the system (equilibrium constant for each reaction, stoichiometric conditions, electroneutrality condition in the solution phase). With the phase-composition requirements identified, and with adequate thermodynamic data (free energies, equilibrium con-... [Pg.14]

Nevertheless, when this article is continued after two decades, it should not remain restricted to stereochemical problems. During that time, other very powerful methods will have been developed which are mostly easier and often also more reliable. Particularly, the recent development in X-ray analysis gives a completely reliable proof of configuration valid even for the isolated molecule in the case of conformation it may appear necessary to prove that it is unchanged in solution (see for instance Reference 3). While X-ray is the most reliable method, NMR spectroscopy is the fastest. It still uses some empirical rules and comparison with model compounds, but in a modem version (2-D NMR, NOE) it is also completely trustworthy. Therefore, many recent dipole-moment studies investigated compounds whose steric arrangement was already known, and attention was focused on the electron distribution on the individual bonds, or in conjugated systems. The difference in the point of view may be explained as follows. [Pg.262]


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Model solutions

Solutal model

Solute model

Solution systems

Solution systems model

Solution systems model solute

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