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               CHAPTER 14        NONLINEAR REGRESSION USING THE SOLVER            --


                   smallest HETP; too fast and there is not sufficient time for equilibration, too
                   slow and gaseous diffusion allows the components to re-mix.
                   The  van  Deemter  Equation  describes  the  relationship  between  HETP  and
                   carrier gas flow rate:

                                         HETP = A + 23/11 + Cv


                   where v  =  carrier gas flow velocity.  The data in Table  14-5 (also on the
                   CD) shows measurements of HETP for a gas chromatographic column, using
                   different flow rates.


                                     Table 14-5.  Gas chromatography data.
                                        v, cmlsec    HETP, cm
                                           0.9          0.64
                                     I     1.5    I     0.51     I

                                           3.0          0.42
                                           4.2          0.47
                                     I     5.6  I       0.55  I

                                           7.0          0.63
                                           8.0          0.69
                                           9.0          0.75





               6.  NMR Titration. The protonation constants K1 and K2 of a diprotic acid H2A
                   were determined by NMR titration.  (Protonation constants, for example,

                                             H++L%HL                K1= [HLI 1 WI [Ll
                   are used in this example because they simplify the equilibrium expressions
                   The chemical shift S of a hydrogen near the acidic sites was measured  at a
                   number of pH values over the range pH  1 to pH  11.  The data are shown in
                   the following Figure (data table and figure are on the CD that accompanies
                   this book).
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