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Lattice stabilities definition

However, on the basis of calculations of lattice stabilities from spectroscopic data. Brewer (1967, 1979) has consistently maintained that interaction coefficients can change drastically with composition, and that extrapolated lattice stabilities obtained with simple models should therefore be considered as only effective values. While this may indeed be true when mechanical instability occurs, many of the assumptions which underlie Brewer s methodology are questionable. A core principle of the spectroscopic approach is the derivation of promotion energies which require the definition of both ground and excited levels. Assumptions concerning the relevant excited state have always been strongly coloured by adherence to the empirical views of Engel (1964) and Brewer (1967). By definition, the choice... [Pg.157]

Some examples of equations based on adding a simple PAV term to the definition of lattice stabilities are given in Table 6.6 (adapted from Kaufman and Bernstein 1970). [Pg.178]

Secondly, the Llo structure must be stable with respect to both small and large strains. The former is assured by the positive definiteness of elastic moduli. Clearly, an exhaustive test of the stability with respect to large strains cannot be made and the following two types of tests were performed. First, the energy of the structure was calculated as a function of strains corresponding to 20% changes in the lattice parameters a and... [Pg.358]

As Skinner has pointed out [7], there is no evidence for the existence of BFyH20 in the gas phase at ordinary temperatures, and the solid monohydrate of BF3 owes its stability to the lattice energy thus D(BF3 - OH2) must be very small. The calculation of AH2 shows that even if BFyH20 could exist in solution as isolated molecules at low temperatures, reaction (3) would not take place. We conclude therefore that proton transfer to the complex anion cannot occur in this system and that there is probably no true termination except by impurities. The only termination reactions which have been definitely established in cationic polymerisations have been described before [2, 8], and cannot at present be discussed profitably in terms of their energetics. It should be noted, however, that in systems such as styrene-S C/4 the smaller proton affinity of the dead (unsaturated or cyclised) polymer, coupled, with the greater size of the anion and smaller size of the cation may make AHX much less positive so that reaction (2) may then be possible because AG° 0. This would mean that the equilibrium between initiation and termination is in an intermediate position. [Pg.181]

A free radical (often simply called a radical) may be defined as a species that contains one or more unpaired electrons. Note that this definition includes certain stable inorganic molecules such as NO and N02, as well as many individual atoms, such as Na and Cl. As with carbocations and carbanions, simple alkyl radicals are very reactive. Their lifetimes are extremely short in solution, but they can be kept for relatively long periods frozen within the crystal lattices of other molecules.137 Many spectral138 measurements have been made on radicals trapped in this manner. Even under these conditions the methyl radical decomposes with a half-life of 10 to 15 min in a methanol lattice at 77 K.139 Since the lifetime of a radical depends not only on its inherent stability, but also on the conditions under which it is generated, the terms persistent and stable are usually used for the different senses. A stable radical is inherently stable a persistent radical has a relatively long lifetime under the conditions at which it is generated, though it may not be very stable. [Pg.186]

Random Walks on a One-Dimensional Lattice. We consider [249, 251] stable random walks on a one-dimensional lattice. Here the particle moves at random, and the direction is defined by the direction of the previous step. Each step is only carried out to the nearest neighbor. The mathematical definition of stability demands that at any time and position on the lattice of the wandering particle, two previous coordinates and the direction of the previous step be known. To describe the random walk process, we consider two probabilities, p,i 1 and p, where pi is the probability to be at place j at step n from place j — 1 at the previous step, is the same probability but from place j + 1. [Pg.267]

The term epitaxy is used to describe the growth of a monocrystalline film of one material in a definite crystallographic orientation on a crystal face of another material, the substrate. To promote growth, there must be a correspondence of both lattices at the interface. A misfit between film and substrate results in stresses as the film grows laterally, which may affect the stability of the deposited crystal. The magnetic properties of LPE garnet films can be optimised by varying this misfit. [Pg.79]

A definite inverse relationship exists between the thermal stability and radiation stability of rubbers. Thus, nitrile, polysiloxane, and fluorine-containing raw rubbers are the most thermally stable and the most unstable with respect to ionizing radiations. A significant influence on the radiation stability of cured rubbers is exerted by various three-dimensional structures formed during the process of vulcanization, as well as by the Ingredients (vulcanizing substances, fillers, softeners). Thus, sulfur and thiuram (free and bound) decelerate radiation structuring [69, 70], Carbon blacks participate in the formation of a space lattice under the action of y-radiation [61, 71-76],... [Pg.332]


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See also in sourсe #XX -- [ Pg.129 ]




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Lattice stabilization

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