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Microscopic level

Conservation laws at a microscopic level of molecular interactions play an important role. In particular, energy as a conserved variable plays a central role in statistical mechanics. Another important concept for equilibrium systems is the law of detailed balance. Molecular motion can be viewed as a sequence of collisions, each of which is akin to a reaction. Most often it is the momentum, energy and angrilar momentum of each of the constituents that is changed during a collision if the molecular structure is altered, one has a chemical reaction. The law of detailed balance implies that, in equilibrium, the number of each reaction in the forward direction is the same as that in the reverse direction i.e. each microscopic reaction is in equilibrium. This is a consequence of the time reversal syimnetry of mechanics. [Pg.378]

Gas-phase reactions play a fundamental role in nature, for example atmospheric chemistry [1, 2, 3, 4 and 5] and interstellar chemistry [6], as well as in many teclmical processes, for example combustion and exliaust fiime cleansing [7, 8 and 9], Apart from such practical aspects the study of gas-phase reactions has provided the basis for our understanding of chemical reaction mechanisms on a microscopic level. The typically small particle densities in the gas phase mean that reactions occur in well defined elementary steps, usually not involving more than three particles. [Pg.759]

The two main amphibole asbestos fibers are amosite and crocidoHte, and both are hydrated siHcates of iron, magnesium, and sodium. The appearance of these fibers and of the corresponding nonfibrous amphiboles is shown in Figure 1. Although the macroscopic visual aspect of clusters of various types of asbestos fibers is similar, significant differences between chrysotile and amphiboles appear at the microscopic level. Under the electron microscope, chrysotile fibers are seen as clusters of fibrils, often entangled, suggesting loosely bonded, flexible fibrils (Fig. 2a). Amphibole fibers, on the other hand, usually appear as individual needles with a crystalline aspect (Fig. 2b). [Pg.346]

Analysis of microscopical data shows that all samples synthesized have the particles of spherical form. On the electron microscopical level on the sorbent surface the nanostructure in the form of fine elements (100-500 nm). For hybrid sorbents synthesis these elements are smaller and more homogeneous due to more effective conditions of synthesis (mixing of PES and ZrOCl, solutions, treatment of prepared MSS in ZrOCl, solution). [Pg.203]

Figure 19.2 shows, at a microscopic level, what is going on. Atoms diffuse from the grain boundary which must form at each neck (since the particles which meet there have different orientations), and deposit in the pore, tending to fill it up. The atoms move by grain boundary diffusion (helped a little by lattice diffusion, which tends to be slower). The reduction in surface area drives the process, and the rate of diffusion controls its rate. This immediately tells us the two most important things we need to know about solid state sintering ... [Pg.195]

Biological membranes provide the essential barrier between cells and the organelles of which cells are composed. Cellular membranes are complicated extensive biomolecular sheetlike structures, mostly fonned by lipid molecules held together by cooperative nonco-valent interactions. A membrane is not a static structure, but rather a complex dynamical two-dimensional liquid crystalline fluid mosaic of oriented proteins and lipids. A number of experimental approaches can be used to investigate and characterize biological membranes. However, the complexity of membranes is such that experimental data remain very difficult to interpret at the microscopic level. In recent years, computational studies of membranes based on detailed atomic models, as summarized in Chapter 21, have greatly increased the ability to interpret experimental data, yielding a much-improved picture of the structure and dynamics of lipid bilayers and the relationship of those properties to membrane function [21]. [Pg.3]

The simplified failure envelopes are not derived from physical theories of failure in which the actual physical processes that cause failure on a microscopic level are integrated to obtain a failure theory. We, instead, deal with phenomenological theories in which we ignore the actual failure mechanisms and concentrate on the gross macroscopic events of failure. Phenomenological theories are based on curve-fitting, so they are failure criteria and not theories of any kind (the term theory implies a formal derivation process). [Pg.102]

Since the interface behaves like a capacitor, Helmholtz described it as two rigid charged planes of opposite sign [2]. For a more quantitative description Gouy and Chapman introduced a model for the electrolyte at a microscopic level [2]. In the Gouy-Chapman approach the interfacial properties are related to ionic distributions at the interface, the solvent is a dielectric medium of dielectric constant e filling the solution half-space up to the perfect charged plane—the wall. The ionic solution is considered as formed... [Pg.803]

In the previous section we saw on an example the main steps of a standard statistical mechanical description of an interface. First, we introduce a Hamiltonian describing the interaction between particles. In principle this Hamiltonian is known from the model introduced at a microscopic level. Then we calculate the free energy and the interfacial structure via some approximations. In principle, this approach requires us to explore the overall phase space which is a manifold of dimension 6N equal to the number of degrees of freedom for the total number of particles, N, in the system. [Pg.806]

Let us underline some similarities and differences between a field theory (FT) and a density functional theory (DFT). First, note that for either FT or DFT the standard microscopic-level Hamiltonian is not the relevant quantity. The DFT is based on the existence of a unique functional of ionic densities H[p+(F), p (F)] such that the grand potential Q, of the studied system is the minimum value of the functional Q relative to any variation of the densities, and then the trial density distributions for which the minimum is achieved are the average equihbrium distributions. Only some schemes of approximations exist in order to determine Q. In contrast to FT no functional integrations are involved in the calculations. In FT we construct the effective Hamiltonian p f)] which never reduces to a thermo-... [Pg.807]

The cells of the latter three types contain only a single nucleus and are called myocytes. The cells of skeletal muscle are long and multinucleate and are referred to as muscle fibers. At the microscopic level, skeletal muscle and cardiac muscle display alternating light and dark bands, and for this reason are often referred to as striated muscles. The different types of muscle cells vary widely in structure, size, and function. In addition, the times required for contractions and relaxations by various muscle types vary considerably. The fastest responses (on the order of milliseconds) are observed for fast-twitch skeletal... [Pg.540]

Computer simulation generates information at the microscopic level, and the conversion of this information into macroscopic terms is the province of statistical thermodynamics. An experimentally observable property A is just the time average of A(F) taken over a long time interval,... [Pg.59]

It is this nonlinear feedback between the information describing individual species (or the system s microscopic level) and the global ecology (or the system s macro-... [Pg.558]

The short answer is that the ON/OFF bits are real on the microscopic level and the objects are real on a higher, emergent level. A glider is a specific pattern of lower-level bits that, unless it comes into contact with other patterns, is faithfully reproduced in a diagonally displaced position every four iterations. The deeper answer is that both questions are ill-posed because neither object nor real can be objectively defined. Both terms can be understood only when interpreted modulo a specific dynamical level. [Pg.697]

What Schwarz appears to be implying, although this is nowhere stated explicitly, is the following parallel between the elements as basic and simple substances at both the macroscopic and microscopic levels. [Pg.139]

The behavior of the strain softened material resembles the behavior of rubberlike polymers. For instance, the Poisson s ratio of an ideally plastic material is also close to 0.5 [94, 95], Proper understanding of crack propagation involves the microscopic level. Apparently, the load is transmitted by the molecular strands [97] from one crosslink to the next crosslink, exactly, as it is in rubberlike materials. However, two things are different in strain softened polymers as compared to rubberlike materials ... [Pg.346]

In order to really assess the magnitude of the electrostatic effect in lysozyme on a microscopic level it is important to simulate the actual assumed chemical process. This can be done by describing the general acid catalysis reaction in terms of the following resonance structures ... [Pg.160]


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