Relativistic transition wavelenghts and probabilities for spectral lines of Ne II

Transition wavelengths and probabilities for several 2p4 3p - 2p4 3s and 2p4 3d - 2p4 3p lines in fuorine-like neon ion (NeII) have been calculated within the multiconfiguration Dirac-Fock (MCDF) method with quantum electrodynamics (QED) corrections. The results are compared with all existing experimental and theoretical data

The nonrelativistic limit of Dirac-Fock codes: the role of Brillouin configurations

We solve a long standing problem with relativistic calculations done with the widely used Multi-Configuration Dirac-Fock Method (MCDF). We show, using Relativistic Many-Body Perturbation Theory (RMBPT), how even for relatively high-$Z$, relaxation or correlation causes the non-relativistic limit of states of different total angular momentum but identical orbital angular momentum to have different energies. We show that only large scale calculations that include all single excitations, even those obeying the Brillouin's theorem have the correct limit. We reproduce very accurately recent high-precision measurements in F-like Ar, and turn then into precise test of QED. We obtain the correct non-relativistic limit not only for fine structure but also for level energies and show that RMBPT calculations are not immune to this problem.Comment: AUgust 9th, 2004 Second version Nov. 18th, 200

Relativistic Calculation of two-Electron one-Photon and Hypersatellite Transition Energies for 12≤Z≤3012\leq Z\leq30 Elements

Energies of two-electron one-photon transitions from initial double K-hole states were computed using the Dirac-Fock model. The transition energies of competing processes, the K$\alpha$ hypersatellites, were also computed. The results are compared to experiment and to other theoretical calculations.Comment: accepted versio

QED self-energy contribution to highly-excited atomic states

We present numerical values for the self-energy shifts predicted by QED (Quantum Electrodynamics) for hydrogenlike ions (nuclear charge $60 \le Z \le 110$) with an electron in an $n=3$, 4 or 5 level with high angular momentum ($5/2\le j \le 9/2$). Applications include predictions of precision transition energies and studies of the outer-shell structure of atoms and ions.Comment: 20 pages, 5 figure

An efficient modeling framework for wall heat flux prediction in rocket combustion chambers using non adiabatic flamelets and wall-functions

In this work an efficient numerical framework for the prediction of wall heat loads in Liquid Rocket Engine combustion chambers is presented. The proposed framework is based on a new version of the non-adiabatic flamelet model and on wall functions for turbulent boundary layer modeling. Different wall function models are applied to 2D and 3D wall heat flux simulations of an experimental single-element gaseous oxygen-gaseous methane combustor in an Unsteady Reynolds Averaged Navier Stokes context. A systematic analysis and a comprehensive comparison of the selected wall models is carried out. The role of the constant or variable properties assumption on the near-wall turbulent quantities affecting the wall heat flux is assessed and the resulting friction velocity scaling investigated. When the skin friction velocity based on the local turbulent kinetic energy is defined by considering constant properties across the boundary layer, the equilibrium boundary layer assumption is not fulfilled and a significant overestimation of the wall heat flux is observed. Results obtained with the corrected near-wall turbulence modeling, on the other hand, showed a substantial improvement in terms of wall heat flux when compared with both experimental data and higher fidelity simulations results

Toward high-precision values of the self energy of non-S states in hydrogen and hydrogen-like ions

The method and status of a study to provide numerical, high-precision values of the self-energy level shift in hydrogen and hydrogen-like ions is described. Graphs of the self energy in hydrogen-like ions with nuclear charge number between 20 and 110 are given for a large number of states. The self-energy is the largest contribution of Quantum Electrodynamics (QED) to the energy levels of these atomic systems. These results greatly expand the number of levels for which the self energy is known with a controlled and high precision. Applications include the adjustment of the Rydberg constant and atomic calculations that take into account QED effects.Comment: Minor changes since previous versio

Dielectronic Resonance Method for Measuring Isotope Shifts

Longstanding problems in the comparison of very accurate hyperfine-shift measurements to theory were partly overcome by precise measurements on few-electron highly-charged ions. Still the agreement between theory and experiment is unsatisfactory. In this paper, we present a radically new way of precisely measuring hyperfine shifts, and demonstrate its effectiveness in the case of the hyperfine shift of $4s\_{1/2}$ and $4p\_{1/2}$ in $^{207}\mathrm{Pb}^{53+}$. It is based on the precise detection of dielectronic resonances that occur in electron-ion recombination at very low energy. This allows us to determine the hyperfine constant to around 0.6 meV accuracy which is on the order of 10%

Effects of Fe doping in La1/2Ca1/2MnO3

The effect of Fe doping in the Mn site on the magnetic, transport and structural properties of polycrystalline La1/2Ca1/2MnO3 was studied. Doping with low Fe concentration (< 10%) strongly affects electrical transport and magnetization. Long range charge order is disrupted even for the lowest doping level studied (~2%). For Fe concentration up to 5% a ferromagnetic state develops at low temperature with metallic like conduction and thermal hysteresis. In this range, the Curie temperature decreases monotonously as a function of Fe doping. Insulating behavior and a sudden depression of the ferromagnetic state is observed by further Fe doping.Comment: 2 pages, presented at ICM2000, to appear in JMM

Parametrization of the angular correlation and degree of linear polarization in two-photon decays of hydrogen-like ions

The two-photon decay in hydrogen-like ions is investigated within the framework of second order perturbation theory and Dirac's relativistic equation. Special attention is paid to the angular correlation of the emitted photons as well as to the degree of linear polarization of one of the two photons, if the second is just observed under given angles. Expressions for the angular correlation and the degree of linear polarization are expanded in terms of $\cos\theta$-polynomials, whose coefficients depend on the atomic number and the energy sharing of the emitted photons. The effects of including higher (electric and magnetic) multipoles upon the emitted photon pairs beyond the electric-dipole approximation are also discussed. Calculations of the coefficients are performed for the transitions $2s_{1/2}\rightarrow1s_{1/2}$, $3d_{3/2}\rightarrow1s_{1/2}$ and $3d_{5/2}\rightarrow1s_{1/2}$, along the entire hydrogen isoelectronic sequence ($1\le Z \le 100$)