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Transformation weighting

The transformed weight corresponding to 5, is the wave function (4.1) normalization condition w = w + W3 = 1. Thus, the solvent force constant matrix elements Km and K m, m = [1,3], bear no dependence on the solute electronic structure, since their components K% and KP°J, are zero [cf. (3.5)]. Then, Si cannot couple to the solute electronic structure, and is unable to monitor any rearrangement — due to the variation of the coefficients Ci and c2 — of the solute total charge distribution p. By contrast, s3 is associated with Kp - = -r) 3,Wi c -c, and is therefore sensitive to the relative change of the weights of the states 1) and 2). [Pg.275]

Heaviside function A mathematical function whose value is either 0 or 1, depending upon the magnitude of the input (independent variable). One of several so-called thresholding functions used in neural networks to transform weighted sums of inputs into a neuron into a binary output response. [Pg.173]

Which equation to use in an analysis is for all practical purposes moot since all methods produce equivalent BSA estimates. Bailey and Briars (1996) asked the question Why do all these formulas produce equivalent results when their constant terms [i.e., c, a1 and a2 in Eq. (8.4)] are so different They first analyzed the 401 subjects Gehan and George used to produce their equation and noted that height and weight were highly correlated. Ln-transformed height was a linear function of Ln-transformed weight... [Pg.276]

Ruppert, D., Cressie, N., and Carroll, R.J. A transformation/ weighting model for estimating Michaelis-Menten parameters. Biometrics 1989 45 637-656. [Pg.377]

The transformer weight (for smaller power plants) needs to be low for easy transportation. To achieve this one may go for higher frequency AC to allow smaller transformer, but this may also lead to more power loss in the switching device. [Pg.209]

The main justification for diesel fuel desulfurization is related to particulate emissions which are subject to very strict rules. Part of the sulfur is transformed first into SO3, then into hydrated sulfuric acid on the filter designed to collect the particulates. Figure 5.21 gives an estimate of the variation of the particulate weights as a function of sulfur content of diesel fuel for heavy vehicles. The effect is greater when the test cycle contains more high temperature operating phases which favor the transformation of SO2 to SO3. This is particularly noticeable in the standard cycle used in Europe (ECE R49). [Pg.254]

The offered method has allowed essentially to simplify the X-ray apparatus main circuit, to reduce weight and dimensions of the apparatus, to increase sensitivity and reliability of the inspection and to ensure the apparatus control by a computer The main principle is based on the operation of the transformer controlled by magnetic commutation (TCMC). [Pg.430]

The standard analytic procedure involves calculating the orthogonal transformation matrix T that diagonalizes the mass weighted Hessian approximation H = M 2HM 2, namely... [Pg.247]

These nine Qr,j are expressed as unitary transformations of the original mass weighted Cartessian eoordinates ... [Pg.354]

These transformation eoeffieients Crj,k can be used to earry out a unitary transformation of the 9x9 mass-weighted Hessian matrix. In so doing, we need only form bloeks... [Pg.354]

My faculty colleagues of the Institute also bring great expertise in the areas of anionic, cationic, and radical polymerization to the transformation of low-molecular-weight hydrocarbons into macromole-... [Pg.134]

The functions put into the determinant do not need to be individual GTO functions, called Gaussian primitives. They can be a weighted sum of basis functions on the same atom or different atoms. Sums of functions on the same atom are often used to make the calculation run faster, as discussed in Chapter 10. Sums of basis functions on different atoms are used to give the orbital a particular symmetry. For example, a water molecule with symmetry will have orbitals that transform as A, A2, B, B2, which are the irreducible representations of the C2t point group. The resulting orbitals that use functions from multiple atoms are called molecular orbitals. This is done to make the calculation run much faster. Any overlap integral over orbitals of different symmetry does not need to be computed because it is zero by symmetry. [Pg.20]

Transforming to mass-weighted coordinates, equation (210) can be rewritten into a set of 3N simultaneous linear differential equations... [Pg.334]

A cross-linked polymer has a density of 0.94 g cm" at 25°C and a molecular weight between crosslinks of 28,000. The conformation of one bond in the middle of the molecule changes from trans to gauche, and the molecule opens up by 120°. In w-butane, the trans to gauche transformation requires about 3.3 kJ mol". Estimate a value for AH of stretching based on this model, and use the law of cosines to estimate the magnitude of the opening up that results. [Pg.142]

Sulfur hexafluoride [2551-62-4] 6 molecular weight 146.07, is a colorless, odorless, tasteless gas. It is not flammable and not particularly reactive. Its high chemical stabiUty and excellent electrical characteristics have led to widespread use in various kinds of electrical and electronic equipment such as circuit breakers, capacitors, transformers, microwave components, etc (see Electronic materials). Other properties of the gas have led to limited usage in a variety of unique appHcations ranging from medical appHcations to space research. [Pg.240]

Most hydrocarbon resins are composed of a mixture of monomers and are rather difficult to hiUy characterize on a molecular level. The characteristics of resins are typically defined by physical properties such as softening point, color, molecular weight, melt viscosity, and solubiHty parameter. These properties predict performance characteristics and are essential in designing resins for specific appHcations. Actual characterization techniques used to define the broad molecular properties of hydrocarbon resins are Fourier transform infrared spectroscopy (ftir), nuclear magnetic resonance spectroscopy (nmr), and differential scanning calorimetry (dsc). [Pg.350]

Transformations in the Solid State. From a practical standpoint, the most important soHd-state transformation of PB involves the irreversible conversion of its metastable form II developed during melt crystallization into the stable form I. This transformation is affected by the polymer molecular weight and tacticity as well as by temperature, pressure, mechanical stress, and the presence of impurities and additives (38,39). At room temperature, half-times of the transformation range between 4 and 45 h with an average half-time of 22—25 h (39). The process can be significantly accelerated by annealing articles made of PB at temperatures below 90°C, by ultrasonic or y-ray irradiation, and by utilizing various additives. Conversion of... [Pg.427]

Mass Spectrometry. Field desorption mass spectrometry has been used to analy2e PPO (179). Average molecular weight parameters (M and could be determined using either protonated (MH + ) or cation attachment (MNa + ) ions. Good agreement was found between fdms and data supphed by the manufacturer, usually less than 5% difference in all cases up to about 3000 amu. Laser desorption Fourier transform mass spectrometry was used to measure PPG ion and it was claimed that ions up to m/2 9700 (PEG) can be analy2ed by this method (180). [Pg.354]


See other pages where Transformation weighting is mentioned: [Pg.196]    [Pg.62]    [Pg.176]    [Pg.196]    [Pg.62]    [Pg.176]    [Pg.891]    [Pg.1539]    [Pg.266]    [Pg.515]    [Pg.73]    [Pg.156]    [Pg.101]    [Pg.23]    [Pg.269]    [Pg.287]    [Pg.185]    [Pg.322]    [Pg.324]    [Pg.196]    [Pg.312]    [Pg.122]    [Pg.455]    [Pg.200]    [Pg.245]    [Pg.376]    [Pg.400]    [Pg.496]    [Pg.148]    [Pg.298]    [Pg.469]    [Pg.161]    [Pg.308]    [Pg.148]   
See also in sourсe #XX -- [ Pg.72 ]




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