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Calculator roots from

Although we will not need it for our later quantum mechanical calculation, we may be curious to evaluate the second root and we shall certainly want to check to be sure that the root we have found is the smaller of the two. Write a program to evaluate the left side of Eq. (1-10) at integral values between 1 and 100 to make an approximate location of the second root. Write a second program to locate the second root of matr ix Eq. (1-10) to a precision of six digits. Combine the programs to obtain both roots from one program run. [Pg.7]

The single dose of a drug is mo.stly derived from experience it is only possible in a very few cases to calculate it from the activity of the constituents. However, as many herbal drugs arc only weakly active and contain non-toxic substances, i.e, the therapeutic index is large, exceeding the dose is usually only of minor significance nevertheless, the pharmacist must know what the exceptions are in this book, the sections on Side effects and Making the tea draw particular attention to such cases, c.g. arnica flowers, liquorice root, etc. [Pg.24]

The calculated root-mean-square displacement for a general sequence of jumps has two terms in Eq. 7.31. The first term, NT(r2), corresponds to an ideal random walk (see Eq. 7.47) and the second term arises from possible correlation effects when successive jumps do not occur completely at random. [Pg.158]

The so-called method of orthogonal operators, mentioned in the Introduction, looks fairly promising in semi-empirical calculations [20,34,134]. Its main advantage is that the addition of new parameters practically does not change the former ones. As a rule this approach allows one to reduce the root-mean-deviation of calculated values from the measured ones by an order of magnitude or so in comparison with the conventional semi-empirical method [135]. Unfortunately it requires the calculation of complex matrix elements of many-electron operators. [Pg.255]

Equations (4) through (7) produce more reliable estimates of Kow and S for hydrophobic dyes than other methods. Isnard and Lambert (1989) calculated root mean square deviations for a dataset of 20 disperse and solvent dyes, using a number of available equations They showed that equations in the form of Equation (4) had root mean square deviations (a) values of 1.6 to 3.3 log Kow units, regressions in the form of equations (6) and (7) gave c values ranging from 1.3 to 3.3, and equations similar to Equation (5) had root mean square deviations ranging from 0.57 to 1.4. [Pg.483]

In this general formulation of the hierarchical clustering problem, the internal criterion J t) is calculated recursively from all the subtrees u of t. The value e(u) is sometimes called the level of the subtree u in the dendrogram. In keeping with this interpretation, e is nonincreasing along paths from the root to the leaves. [Pg.138]

The reaction rate initially increases with time as the temperature increases, and then peaks and drops to zero as the reactant is consumed. The temperature at the maximum reaction rate, Tp, can be used as the effective temperature for the reaction. We can calculate Tp from the rate parameters by differentiating the right-hand side of Equation (1) with respect to T, setting the derivative equal to zero, and finding the roots of the resulting equation... [Pg.93]

Case C. Exact solution without further assumptions. Equation (6-82) is a polynomial with C roots. Solve this equation for all values of 0 lying between the relative volatilities of all components. This gives C - 1 valid roots. Now, write equation (6-78) C -1 times, once for each value of < >. There are now C - 1 equations in C - 1 unknowns (Vmin, and Dxj0 for all nonkeys). Solve these simultaneous equations calculate D from equation (6-84) calculate Lmin from equation (6-83). [Pg.376]

Stoichiometry roots from aroix a, which means letter or basic matter, and ixsrpv, which means measure. This particular topic of chemistry is engaged with the setup of chemical formulas and the description of chemical reactions. Only if the stoichiometry of a chemical reaction is known, the yield can be calculated. Stoichiometry was found by Richter [1], Richter lived in Breslau and was a chemist and mining expert. [Pg.379]

The structure of the program follows (see Program 5, page 121). The subroutine JCOBI calculates roots and derivatives of the polynomial. The subroutine DFOPR calculates parameters Ai j and Bij associated with these roots. The subroutine FUN supplies information about the differential equations F is the vector on the right-hand side of Eq. (89). The subroutine OUT is the output subroutine. The latter two subroutines are supplied to DFOPR from the IMSL library, which solves a system of first-order differential equations with given initial conditions. The p optimization is included in this program theory behind P is detailed else-where. ... [Pg.105]

Equation (5.13) is usually considered to be the quantitative statement of the Heisenberg uncertainty principle (Section 1.3). However, the meaning of the standard deviations in Eqs. (5.12) and (5.13) is rather different than the meaning of the uncertainties in Section 1.3. To find Ax in (5.13) we take a very large number of systems, each of which has the same state function and we perform one measurement of x in each system. From these measured values, symbolized by we calculate (x) and the squares of the deviations (x, - (x)). We average the squares of the deviations to get the variance and take the square root to get the standard deviation cr(x) = Ax. Then we take many systems, each of which is in the same state 4 as used to get Ax, and we do a single measurement of p c in each system, calculating Ap from these measurements. Thus, the statistical quantities Ax and Ap in (5.13) are not errors of individual measurements and are not found from simultaneous measurements of x and Px (see Ballentine, pp. 225-226). [Pg.92]


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