atomic data for ti xix

1
K. M. Aggarwal and F. P. Keenan Astrophysics Research Centre, School of Mathematics and Physics, Queen's University Belfast, Belfast BT7 1NN, Northern Ireland Introduction Emission lines from several ionisation stages of titanium, including Be-like Ti XIX, have been observed in laser produced plasmas in the 12-15 Å region. The n=2 to n=4 lines are of particular interest in the development of lasers due to population inversion. To analyse observations, atomic data are required for a variety of parameters, such as energy levels, radiative rates (A- values), and excitation rates or equivalently the effective collision strengths (ϒ), which are obtained from the electron impact collision strengths (Ω). Similarly, atomic data for Ti ions are useful to analyse impurity content and transport in tokamak plasmas. Experimentally, energy levels are available for Ti XIX on the NIST website. Similarly, A- values are also available for some transitions on the NIST website, but there is paucity for accurate collisional atomic data for Ti XIX. Therefore, here we calculate a complete set of results (namely energy levels, radiative rates, and effective collision strengths) for all transitions among the lowest 98 levels of Ti XIX. These levels belong to the (1s 2 ) 2s 2 , 2s2p, 2p 2 , 2s3l, 2p3l, 2s4l, and 2p4l configurations. Finally, we also report the A- values for four types of transitions, namely electric dipole (E1), electric quadrupole (E2), Magnetic dipole (M1), and magnetic quadrupole (M2), because these are also required for plasma modelling. Calculations For our calculations of wavefunctions, we have adopted the fully relativistic (GRASP) code, which is based on the jj coupling scheme. Further relativistic corrections arising from the Breit interaction and QED effects have also been included. Additionally, we have used the option of extended average level (EAL), in which a weighted (proportional to 2j+1) trace of the Hamiltonian matrix is minimized. For the calculations of Ω, the Dirac atomic R-matrix code (DARC) of PH Norrington and IP Grant has been adopted. In our calculations, the R-matrix radius is 3.64 au, and 55 continuum orbitals have been included for each channel angular momentum for the expansion of the wavefunctions. The maximum number of channels for a partial wave is 428, and the corresponding size of the Hamiltonian matrix is 23579. This allows us to calculate values of Ω up to an energy of 1130 Ryd, and values of ϒ up to a temperature of 10 7.7 K, suitable for applications in a variety of plasmas. Furthermore, resonances in the thresholds region are being resolved in a fine energy mesh of better than 0.002 Ryd. Additionally, parallel calculations have also been performed with the Flexible Atomic Code (FAC) of Gu, so that all atomic parameters can be rigorously assessed for accuracy. At present resonances are being resolved as their importance can be appreciated from Figs. 6-11 shown here. Results and Conclusions Energy levels and their lifetimes are listed in Table 1. Measurements of many energy levels are not available and some measurements are non-degenerate. All levels agree within 0.1 Ryd with the measurements, except three (32, 46 and 85) which differ by up to 0.3 Ryd. Inclusion of n=5 levels makes no appreciable difference either to energies or to their orderings. GRASP and FAC energy levels agree within 0.05 Ryd and orderings are also the same.

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Poster presented by K. M. Aggarwal and F. P. Keenan at 11th International Conference on Atomic Processes in Plasmas, Queen's University Belfast, 19-22 July 2011

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Page 1: Atomic data for Ti XIX

ATOMIC DATA FOR Ti XIX K. M. Aggarwal and F. P. Keenan

Astrophysics Research Centre, School of Mathematics and Physics, Queen's University Belfast, Belfast BT7 1NN, Northern Ireland

Introduction Emission lines from several ionisation stages of titanium, including Be-like Ti XIX,

have been observed in laser produced plasmas in the 12-15 Å region. The n=2 to

n=4 lines are of particular interest in the development of lasers due to population

inversion. To analyse observations, atomic data are required for a variety of

parameters, such as energy levels, radiative rates (A- values), and excitation rates or

equivalently the effective collision strengths (ϒ), which are obtained from the electron

impact collision strengths (Ω). Similarly, atomic data for Ti ions are useful to analyse

impurity content and transport in tokamak plasmas.

Experimentally, energy levels are available for Ti XIX on the NIST website. Similarly,

A- values are also available for some transitions on the NIST website, but there is

paucity for accurate collisional atomic data for Ti XIX. Therefore, here we calculate a

complete set of results (namely energy levels, radiative rates, and effective collision

strengths) for all transitions among the lowest 98 levels of Ti XIX. These levels

belong to the (1s2) 2s2, 2s2p, 2p2, 2s3l, 2p3l, 2s4l, and 2p4l configurations. Finally,

we also report the A- values for four types of transitions, namely electric dipole (E1),

electric quadrupole (E2), Magnetic dipole (M1), and magnetic quadrupole (M2),

because these are also required for plasma modelling.

Calculations For our calculations of wavefunctions, we have adopted the fully relativistic (GRASP)

code, which is based on the jj coupling scheme. Further relativistic corrections

arising from the Breit interaction and QED effects have also been included.

Additionally, we have used the option of extended average level (EAL), in which a

weighted (proportional to 2j+1) trace of the Hamiltonian matrix is minimized. For the

calculations of Ω, the Dirac atomic R-matrix code (DARC) of PH Norrington and IP

Grant has been adopted. In our calculations, the R-matrix radius is 3.64 au, and 55

continuum orbitals have been included for each channel angular momentum for the

expansion of the wavefunctions. The maximum number of channels for a partial wave

is 428, and the corresponding size of the Hamiltonian matrix is 23579. This allows us

to calculate values of Ω up to an energy of 1130 Ryd, and values of ϒ up to a

temperature of 107.7 K, suitable for applications in a variety of plasmas. Furthermore,

resonances in the thresholds region are being resolved in a fine energy mesh of

better than 0.002 Ryd. Additionally, parallel calculations have also been performed

with the Flexible Atomic Code (FAC) of Gu, so that all atomic parameters can be

rigorously assessed for accuracy. At present resonances are being resolved as their

importance can be appreciated from Figs. 6-11 shown here.

Results and Conclusions Energy levels and their lifetimes are listed in Table 1.

Measurements of many energy levels are not available and some measurements are non-degenerate.

All levels agree within 0.1 Ryd with the measurements, except three (32, 46 and 85) which differ by up to 0.3 Ryd.

Inclusion of n=5 levels makes no appreciable difference either to energies or to their orderings.

GRASP and FAC energy levels agree within 0.05 Ryd and orderings are also the same.