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Harmonic analysis method

In this method, first used by Navarro et al. [230, 231] and by van Bokhoven [232, 233], the convolution recorded in the frequency domain is accepted as the transformation equation [Eq. (2.8)] of the calorimeter. For the determination of an unknown heat effect, it is assumed that the spectrum transmittance H(j o) ( 2.6) has been determined previously. Next, an unknown heat effect Px(t) is generated and the calorimetric signal Tx(t) is measured. After determination of the spectrum transmittance H(j jo) and the calorimeter response Tft), the thermokinefics Px(t) is obtained as the inverse Fourier transform [Pg.123]

In the dynamic optimization method [234-236], Eq. (2.9) is taken as a mathematical model of the calorimeter, and thus appropriate zero initial conditions are assumed. This method assumes the existence of one input function T(t) and one output function P(t). The impulse response H(t) is determined as a derivative with respect to time of the response of the calorimetric system to a unit step. As a criterion of accordance between the measured temperature change T(t) and the estimated course of temperature x(t), the integral of the square of the difference between these two courses is taken  [Pg.124]

The task of dynamic optimization consists in selection of the unknown thermal powerP(t) so that Eq. (3.Ill) attains a minimum. Such a task can be solved provided that the temperature response T(t) and the impulse response H(t) of the calorimeter are known in the analytical form. However, in calorimetric measurements, numerical values To, T,  [Pg.124]

In the search for the minimum of function (3.112), a conjugate gradient method is used. [Pg.125]


Interpretation of IR spectra therefore becomes fairly intricate. According to Hargittai (2000), electron diffraction data, most of which favor the pyramidal structure of RCI3, also do not give an unambiguous answer to the question of the structure of trichlorides. Indeed, even when the structural parameters are determined from primary electron diffraction data with harmonic analysis methods, this analysis is based on vibrational frequencies, either obtained from experimental spectra or estimated, but the complex vapor composition of these compounds is not taken into... [Pg.178]

Harmonic analysis methods, such as STFT and wavelets, are not entirely adequate for the analysis of sounds with a high proportion of non-sinusoidal components and, to a certain extent, to non-harmonic combinations of partials. The nature of these signals is not compatible with the notion that sounds are composed of harmonically related and stable sinusoids. Formant analysis proposes an alternative method of representation. The sound is represented here in terms of an overall predictive mould that shapes a signal rich in partials, such as a pulse wave or white noise. The advantage of this method is that the predictive mould does not need to specify the frequencies of the spectrum precisely any value within a certain range may qualify. [Pg.57]

Among the main theoretical methods of investigation of the dynamic properties of macromolecules are molecular dynamics (MD) simulations and harmonic analysis. MD simulation is a technique in which the classical equation of motion for all atoms of a molecule is integrated over a finite period of time. Harmonic analysis is a direct way of analyzing vibrational motions. Harmonicity of the potential function is a basic assumption in the normal mode approximation used in harmonic analysis. This is known to be inadequate in the case of biological macromolecules, such as proteins, because anharmonic effects, which MD has shown to be important in protein motion, are neglected [1, 2, 3]. [Pg.332]

Another analysis method was based on the local wave vector estimation (LFE) approach applied on a field of coupled harmonic oscillators.39 Propagating media were assumed to be homogeneous and incompressible. MRE images of an agar gel with two different stiffnesses excited at 200 Hz were successfully simulated and compared very well to the experimental data. Shear stiffnesses of 19.5 and 1.2 kPa were found for the two parts of the gel. LFE-derived wave patterns in two dimensions were also calculated on a simulated brain phantom bearing a tumour-like zone and virtually excited at 100-400 Hz. Shear-stiffnesses ranging from 5.8 to 16 kPa were assumed. The tumour was better detected from the reconstructed elasticity images for an input excitation frequency of 0.4 kHz. [Pg.229]

The use of the impedance technique in the study of polymer coated steel, has been thoroughly described elsewhere. The present paper compares this technique with that of harmonic analysis, originally proposed by Meszaros ). The authors have presented preliminary data using the latter technique(3) wherein the early stages of polymer breakdown have been studied. The current paper extends this work to polymers which have been immersed for a considerable period of time. The harmonic method gives information not available from the impedance technique in the Tafel slopes and the corrosion current are directly measurable. A brief summary of the harmonic method and the equations used are given below. [Pg.31]

It can be seen that for severely degraded specimens, both the harmonic analysis and Impedance techniques are capable of detecting the presence of gross corrosion. The harmonics method provides a reasonable estimation of the corrosion rate when the Impedance data exhibits Warburg type behaviour. For less severely degraded specimens, especially those exhibiting blister attack, the Impedance method Is not as successful as the harmonic analysis technique. [Pg.35]

Where very little corrosion attack has occurred, neither method Is capable of providing reliable quantitative data. The non-appllcab-lllty In certain Instances of the Impedance technique as a monitoring tool has been reported previously. Further experience with the harmonic analysis technique may be capable of refining the results obtained. [Pg.35]

Recently, Darowicki [29, 30] has presented a new mode of electrochemical impedance measurements. This method employed a short time Fourier transformation to impedance evaluation. The digital harmonic analysis of cadmium-ion reduction on mercury electrode was presented [31]. A modern concept in nonstationary electrochemical impedance spectroscopy theory and experimental approach was described [32]. The new investigation method allows determination of the dependence of complex impedance versus potential [32] and time [33]. The reduction of cadmium on DM E was chosen to present the possibility of these techniques. Figure 2 illustrates the change of impedance for the Cd(II) reduction on the hanging drop mercury electrode obtained for the scan rate 10 mV s k... [Pg.770]

In order to determine J(w) den, Fermi performed the harmonic analysis of the electric field of a particle. Fermi s method can be generalized to the... [Pg.301]

Both theoretical analysis and dipole moment measurements indicated that sulfonyl-substituted compounds may have ft coefficients similar in magnitude to their nitro analogues. Therefore, we have measured p for several sulfonyl- and nitro-substituted compounds using electric-field-induced second-harmonic generation method (EFISH) (11,25). In this experiment, one measures an effective third-order nonlinearity rEFISH for a solution containing the compound of interest, given by... [Pg.187]

One of most popular techniques for dynamic mechanical analysis is the torsion pendulum method. In a modification of this method designed to follow curing processes, a torsion bar is manufactured from a braid of fibers impregnated with the composition to be studied this is the so-called torsional braid analysis (TBA) method.61 62,148 The forced harmonic oscillation method has been also used and has proven to be valuable. This method employs various types of rheogoniometers and vibroreometers,1 9,150 which measure the absolute values of the viscoelastic properties of the system under study these properties can be measured at any stage of the process. The use of computers further contributes to improvements in dynamic mechanical analysis methods for rheokinetic measurements. As will be seen below, new possibilities are opened up by applying computer methods to results of dynamic measurements. [Pg.98]

All of these hexafluorides are dimorphic, with a high-temperature, cubic form and an orthorhombic form, stable below the transition temperature (92). The cubic form corresponds to a body-centered arrangement of the spherical units, with very high thermal disorder of the molecules in the lattice, leading to a better approximation to a sphere. Recently, the structures of the cubic forms of molybdenum (93) and tungsten (94) hexafluorides have been studied using neutron powder data, with the profile-refinement method and Kubic Harmonic analysis. In both compounds the fluorine density is nonuniformly distributed in a spherical shell of radius equal to the M—F distance. Thus, rotation is not completely free, and there is some preferential orientation of fluorine atoms along the axial directions. The M—F distances are the same as in the gas phase and in the orthorhombic form. [Pg.107]

A relationship actually exists between periodic and quasiperiodic patterns such that any quasilattice may be formed from a periodic lattice in some higher dimension (Cahn, 2001). The points that are projected to the physical three-dimensional space are usually selected by cutting out a slice from the higher-dimensional lattice. Therefore, this method of constmcting a quasiperiodic lattice is known as the cut-and-project method. In fact, the pattern for any three-dimensional quasilattice (e.g., icosahedral symmetry) can be obtained by a suitable projection of points from some six-dimensional periodic space lattice into a three-dimensional subspace. The idea is to project part of the lattice points of the higher-dimensional lattice to three-dimensional space, choosing the projection such that one preserves the rotational symmetry. The set of points so obtained are called a Meyer set after French mathematician Yves Meyer (b. 1939), who first studied cut-and-project sets systematically in harmonic analysis (Lalena, 2006). [Pg.48]

APPLIED ANALYSIS, Cornelius Lanczos. Classic work on analysis and design ol linite processes for approximating solution of analytical problems. Algebraic equations, matrices, harmonic analysis, quadrature methods, much more. 559pp. 5H x 8H. 65656-X Pa. 11.95... [Pg.117]

Phenomenological treatments which approximate the molecular potential field (Born-Oppenheimer approximation) by a series of classical energy equations and adjustable parameters. These treatments may be called classical mechanical only in the sense that harmonic force-field expressions stemming from vibrational analysis methods are often introduced, though strictly speaking one is free to select any set of functions that reproduces the experimental data whitin chosen limits of accuracy. [Pg.3]

It should be noted that the error analysis methods using measurement models are sensitive to data outliers. Occasionally, outliers can be attributed to external influences. Most often, outliers appear near the line frequency and at the beginning of an impedance measurement. Data collected within 5 Hz of the line frequency and its first harmonic (e.g., 50 and 100 Hz in Europe or 60 and 120 Hz in the United States) should be deleted. Startup transients cause some systems to exhibit a detectable artifact at the first frequency measured. This point, too, should be deleted. [Pg.422]

Another landmark in tidal research was the harmonic tidal analysis method developed in the 1860s and 1870s (Darwin, 1883) by William Thomson (Lord Kelvin) and his co-workers in the Committee for the purpose of promoting the extension, improvement, and harmonic analysis of tidal observations, which was initially headed by him and later by G.H. Darwin. The first harmonic analysis of a Baltic Sea water-level time series (Copenhagen) in 1882 probably originated from this group (Darwin, 1889). [Pg.185]

As a last step the standard deals with data quality analysis. This step should support the validity of the analysis. Methods for more reliable data quality analysis are a present focus of research and international harmonization. [Pg.30]

The spherical harmonic analysis so far presented for uniaxial anisotropy is mainly concerned with the relaxation in a direction parallel to the easy axis of the uniaxial anisotropy. We have not considered in detail the behavior resulting from the transverse application of an external field and the relaxation in that direction for uniaxial anisotropy. Thus we have only considered potentials of the form V(r, t) = V(i, t) where the azimuthal or dependence in Brown s equation is irrelevant to the calculation of the relaxation times. This has simplified the reduction of that equation to a set of differential-difference equations. In this section we consider the reduction when the azimuthal dependence is included. This is of importance in the transition of the system from magnetic relaxation to ferromagnetic resonance. The original study [17] was made using the method of separation of variables on Brown s equation which reduced the solution to an eigenvalue problem. We reconsider the solution by casting... [Pg.372]

The distributed multipole analysis method of Stone and co-workers is similar in concept but is based on nonredundant spherical harmonic representation of the multipoles (recall that whereas there are six second moments, only five are independent). He initially places numerous site multipoles at centers of orbital overlap. The individual monopoles are spread out along the molecular axis, and are thought to represent the distribution of charge the site dipoles are also spread out along the bond axis. This very detailed description is simplified into a three-site model, which includes a site in the F—H bond. However, the multipole expansion does not converge well, especially for the bond center site. [Pg.234]

Line and planar defects arise in crystals during the growth process. Unlike point defects, these features scale with the size of the system (to some power), and their unfavorable energetics cannot be overcome by the additional configuration space they introduce, so they are not present in the equilibrium crystal. Nevertheless, they are sufficiently (meta)stable that they can be examined in the context of equilibrium thermodynamics. Many studies of this form apply some variant of harmonic analysis, rather than employ the rigorous (and time-consuming) methods of molecular simulation. [Pg.136]


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