The phase change in potassium chloride

Equations for the interaction of ions in an ionic crystal, developed earlier¹, which allow for the variation of compressibility with pressure, have been applied to calculation of properties connected with the phase transition of potassium chloride under pressure. The data used were only for the high pressure form of the compound. It was found that the calculated transition pressure was much closer to the observed value, if these equations were used; but simpler equations which use a constant compressibility were somewhat better in their calculated values for the lattice energy, molar volume, and change of volume with pressure for the low pressure form of potassium chloride (NaCl structure). It is concluded that, while calculations on these equations form a sensitive test of these equations, the fitting of the equation to the structure needs to be more elaborate.     

Theoretical calculation of electrode potentials: Electron-withdrawing compounds

The electrode potential of 2,3-dicyanobenzoquinone in aqueous solution has been calculated relative to parabenzoquinone using a thermodynamic cycle approach that includes accurate gasphase ab initio calculations and calculation of differences in free energies of hydration using the free-energy perturbation method. The discrepancy between the calculated and experimental electrode potential is disappointingly large (99 mV) compared to previous studies using this approach. This, along with the experimental evidence, suggests that the experimental value itself is too large and that theoretical approaches may indeed be as reliable as experimental ones for determining redox properties of molecules such as 2,3-dicyanobenzoquinone. In the light of this discrepancy we have examined the variation of the results with the basis set, inclusion of electron correlation and changes in the parameters used in the molecular dynamics free-energy simulations. The results are shown to be dependent upon the torsional parameters and especially dependent upon the basis set or semiempirical method used to obtain the electrostatic potential-derived charges. The best charge set was determined using the ab initio criteria of completeness—as far as it can be applied to large molecules—and also by studying the effect of hydration on these charges. This was done by allowing the solvent to perturb the wave function prior to the electrostatic potential determination. Thus, 3-21G and 6-31G * basis sets were found to give satisfactory results. Similar results were obtained using semiempirical and ab initio geometries.     

Level structure of 22Mg: implications for the 21Na(p,gamma)22Mg astrophysical reaction rate and for the 22Mg Mass

The level structure of (22)Mg has been studied with high-sensitivity gamma-ray spectroscopy techniques. A complete level scheme is derived incorporating all subthreshold states and all levels in the energy region relevant for novae burning. The excitation energy of the most important astrophysical resonance is measured with improved accuracy and found to differ from previous values. Combining the present result with a recent resonance energy measurement of this state leads to a derived (22)Mg mass excess of -400.5(13) keV.     

Entry distribution, fission barrier, and formation mechanism of 254102No

The entry distribution in angular momentum and excitation energy for the formation of 254No has been measured after the 208Pb(48Ca,2n) reaction at 215 and 219 MeV. This nucleus is populated up to spin 22Planck's over 2pi and excitation energy greater, similar6 MeV above the yrast line, with the half-maximum points of the energy distributions at approximately 5 MeV for spins between 12Planck's over 2pi and 22Planck's over 2pi. This suggests that the fission barrier is greater, similar5 MeV and that the shell-correction energy persists to high spin.     

High dynamic range measurement of temporal shape and contrast of ultrashort UV pulses

This paper presents an experimental technique for measurement of the contrast ratio of ultrashort UV pulses. As a multiple-shot device based on the scheme of difference frequency generation this is, to our knowledge, the only cross correlator in the UV so far, which offers a dynamic range of 10⁷ and operates with input pulse energies as low as 5 μJ. By changing the cross correlator into single-shot mode, the temporal shape of the UV pulse can be measured. Received: 26 October 1998 / Revised version: 13 January 1998 / Published online: 28 April 1999     

Eta physics at threshold

The production of - and -mesons in elementary nucleon-nucleon collisions has been investigated at the synchrotrons CELSIUS, COSY and SATURNE. The high-quality proton beam with low emittance and small momentum spread permits to study the creation of these mesons very close to the kinematical threshold, where --due to the rapid growth of the phase space volume-- the total cross-section increases by orders of magnitude over a few MeV range of the excess energy. The magnitude and energy dependence of the total cross-section as well as the occupation distribution of the phase space serve as observables for investigating the mechanisms underlying the production processes and the interaction of mesons with nucleons. The precise data on the and creation via the reactions allowed to settle the general features of the - and -meson production and revealed the sensitivity of the mentioned observables to the nucleon-nucleon-meson final-state interaction. The particular production properties, like for example, the determination of the dominating exchange processes which lead to the excitation of the S ₁₁ nucleon isobar in the case of creation, must be established by confrontation with other observables. The present status of this investigation with an emphasis on the results of the COSY-11 Collaboration is briefly presented. The available data are interpreted in view of the production mechanism and the meson-nucleon interaction.Received: 30 September 2002, Published online: 22 October 2003PACS: 13.60.Le Meson production - 13.75.-n Hadron-induced low- and intermediate-energy reactions and scattering (energy GeV) - 13.85.Lg Total cross sections - 25.40.-h Nucleon-induced reactions