English

Elastic scattering of twisted electrons by CO$_2$ molecules at high energies

Quantum Physics 2026-04-20 v5

Abstract

Elastic scattering of a twisted (Bessel) electron beam by CO2_2 molecules is studied theoretically at high energies. The molecule's structure is optimized using coupled cluster theory and density functional theory with correlation-consistent and Pople basis sets. Coulomb potentials are used in the static approximation. The differential and total scattering cross-sections are computed in the first Born approximation. All cross-sections are orientation-averaged using a passive rotational averaging technique. The scattering is studied by the impact of the twisted beam with topological charges in the range mlm_l = 1 and mlm_l = 20. The cross sections are, in addition, averaged over the target's impact parameters, which accounts for the cross sections of a large distribution of CO2_2 molecules. Finally, the molecule's total cross-section by plane waves and twisted beams is reported. The proposed methodology can be applied to study any polyatomic molecule, regardless of its structure.

Keywords

Cite

@article{arxiv.2407.19801,
  title  = {Elastic scattering of twisted electrons by CO$_2$ molecules at high energies},
  author = {Raul Sheldon Pinto and Rakesh Choubisa},
  journal= {arXiv preprint arXiv:2407.19801},
  year   = {2026}
}

Comments

Accepted version. Published in J. Phys. B: At. Mol. Opt. Phys. 58 (2025) 175102. DOI: 10.1088/1361-6455/ae0221