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We present a quantum treatment of atom–electron collisions in magnetic fields, demonstrating the significant importance of including the effect of exchange that arises from two interacting electrons. We find strange behaviors that are not encountered in collisions without a magnetic field. In high magnetic fields, exchange can lead to orders of magnitude enhancements of collision cross sections. Additionally, the elastic collision cross sections that involve the ground state become comparable to those involving excited states, and states with large orbits have the largest contribution to the collisions. We anticipate significant changes to spectral line broadening in neutron star surfaces and atmospheres.

Neutron star surfaces have extremely high magnetic fields. In the atmosphere, the broadening of spectral lines will be substantial from the dense plasma as well as from the magnetic field. One broadening mechanism of note is due to the motional Stark effect (MSE)—an additional electric field that arises from the motion of the atom in the magnetic field. However, approximate formulae are often used to construct atmosphere models, and the MSE is assumed to be the dominant line-broadening mechanism even in ions. Detailed pressure-broadening models in these extreme magnetic fields are now currently being developed. In these more detailed models, it was suggested that the MSE may not be as large as previously predicted. If correct, this hypothesis implies that neutron star line widths might be dominated by pressure broadening rather than by motional Stark broadening. We find that, in the absence of plasma perturbations, for typical magnetic fields (B = 1012 G), mid-Z elements, such as oxygen, have motional Stark widths of order 1 eV for transitions between dipole-allowed transitions from the ground state, though higher temperatures and transitions to higher-energy states are expected to have more broadening. The MSE also breaks down selection rules, giving rise to forbidden transitions, which have much larger widths. When plasma perturbations are included, we find that the plasma perturbation and motional Stark processes are not independent and, as a result, the spectral lines become narrow in a nontrivial way and display harmonics of the ion cyclotron frequency.

The structure and emergent flux of hydrogen atmosphere white dwarfs depend on the opacity of the Lyα and Lyβ spectral lines. The opacity here is set by the strength and broadening of these lines; the latter is dictated by the far line wing, which is in the “quasi-static” limit of electron broadening, placing it in the incomplete collision regime, and describes the transient parts of electron and ion collisions. These transient stages of the collision form resonances: In the case of ions, they manifest as molecular resonances, while for electrons they are H− resonances, both of which can only be captured quantum-mechanically. Quantum-mechanical calculations have historically preserved only a handful of broadening terms that are most important near the center of the line. However, in the wings of the line, the previously neglected terms that describe the transient stages of the collision need to be included. This requirement arises because, in the line wings, the broadening from the 1s ground state, which is generally assumed to be extremely small compared to the broadening of the upper state, is no longer negligible within a quantum-mechanical model that takes into account exchange interactions. The inclusion of all the transient terms results in asymmetries and extra broadening. The increased broadening of Lyα increases the opacity at the energy where most of the flux leaves the star. The broader Lyα lines also impact the visible flux, raising it by an amount that exceeds previously estimated errors.

We revisit the current status of high-precision calculations for electron-impact excitation of the (1s3s)3,1S states in helium in the low-energy near-threshold regime that is characterized by a large number of resonance features. Having noticed discrepancies between predictions from two previous large-scale calculations for this problem, we report new results and make recommendations regarding the absolute cross-sections that should be used in modeling applications.

A fully relativistic approach to calculating photoionization and photon-atom scattering cross sections for quasi one-electron atoms is presented. An extensive set of photoionization cross sections have been calculated for alkali atoms: lithium, sodium, potassium, rubidium and cesium. The importance of relativistic effects and core polarization on the depth and position of the Cooper minimum in the photoionization cross section is investigated. Good agreement was found with previous Dirac-based B-spline R-matrix calculations of Zatsarinny and Tayal and recent experimental results.

The relativistic convergent close-coupling method is applied to calculate cross sections for electron scattering from atomic tin. We present integrated and momentum-transfer cross sections for elastic scattering from the ground and the first four excited states of tin for projectile energies ranging from 0.1 to 500 eV. Integrated and selected differential cross sections are presented for excitation to the 5p2, 5p6s, 5p5d and 5p6p manifolds from the ground state. The total ionisation cross sections are calculated from the ground and the first four excited states, accounting for the direct ionisation of the 5p valence shell and the closed 5s shell and the indirect contributions from the excitation–autoionisation. The presented results are compared with previous theoretical predictions and an experiment where available. For the total ionisation cross sections, we find good agreement with the experiment and other theories, while for excitation cross sections, the agreement is mixed.

The single-center convergent close-coupling (CCC) method is applied to calculate positron scattering from boron. A model potential approach is utilized to extract the positronium formation, direct ionization, and values between the positronium formation and ionization thresholds. We present results for total, electron loss, elastic, momentum transfer, total bound state excitation, positronium formation, direct ionization, stopping power, and mean excitation energy from 10−5 eV to 5000 eV. For boron, there is only one other set of theoretical positron calculations for elastic and momentum transfer above 500 eV, which is in excellent agreement with the current CCC results. Using the current results for boron atoms and previous CCC calculations for hydrogen and fluorine atoms, positron scattering from BF, BF2, BF3, and BH molecules is calculated for energies between 0.1 eV and 5000 eV with a modified independent atom approach.

Two computational methods developed recently [McNamara, Fursa, and Bray, Phys. Rev. A 98, 043435 (2018)] for calculating Rayleigh and Raman scattering cross sections for atomic hydrogen have been extended to quasi one-electron systems. A comprehensive set of cross sections have been obtained for the alkali atoms: lithium, sodium, potassium, rubidium, and cesium. These cross sections are accurate for incident photon energies above and below the ionization threshold, but they are limited to energies below the excitation threshold of core electrons. The effect of spin-orbit interaction, importance of accounting for core polarization, and convergence of the cross sections have been investigated.

The wave-packet convergent close-coupling approach is used to calculate integrated target excitation and ionisation cross sections in bare beryllium-ion collisions with the 2ℓm states of atomic hydrogen (where n, ℓ and m are the principal, orbital angular momentum and magnetic quantum numbers, respectively). The calculations are performed at representative projectile energies between 10 keV/u to 1 MeV/u. The calculated cross sections for collisions with H(2s) are compared with recent theoretical results. Generally, good agreement is observed for the n-partial excitation and total ionisation cross sections. However, a significant discrepancy is found for excitation into the dominant n=3 states at 100 keV/u, where the target excitation cross-section peaks. We also present the first calculations of the excitation and ionisation cross sections for Be4+ collisions with H(2p0) and H(2p±1).

The two-center wave-packet convergent close-coupling method has been applied to model the processes of electron capture and ionisation in collisions of fully stripped neon and lithium ions with atomic hydrogen at projectile energies from 1 keV/u to 1 MeV/u. For the Ne10+ projectile, the resulting total electron-capture cross section lies between the two sets of experimental results available for system, which differ from each other significantly. For Li3+, our total electron-capture cross section agrees with the available experimental measurements by Shah et al. [J. Phys. B: At. Mol. Opt. Phys 11, L233 (1978)] and Seim et al. [J. Phys. B: At. Mol. Opt. Phys 14, 3475 (1981)], particularly at low and high energies. We also get good agreement with the existing theoretical works, particularly the atomic- and molecular-orbital close-coupling calculations. Our total ionisation cross section overestimates the experimental data by Shah et al. [J. Phys. B: At. Mol. Opt. Phys 15, 413 (1982)] at the peak, however we get good agreement with the other existing theoretical calculations at low and high energies.