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Abstract
The recently developed ab initio many-body theory of positron molecule binding [J. Hofierka et al., Many-body theory of positron binding to polyatomic molecules, Nature (London) 606, 688 (2022)] is combined with the shifted pseudostates method [A. R. Swann and G. F. Gribakin, Model-potential calculations of positron binding, scattering, and annihilation for atoms and small molecules using a Gaussian basis, Phys. Rev. A 101, 022702 (2020)] to calculate positron scattering and annihilation rates on small molecules, namely H2, N2, and CH4. The important effects of positron-molecule correlations are delineated. The method provides uniformly good results for annihilation rates on all the targets, from the simplest (H2, for which only a sole previous calculation agrees with experiment), to larger targets, where high-quality calculations have not been available.
Original language | English |
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Article number | 263001 |
Journal | Physical Review Letters |
Volume | 130 |
Issue number | 26 |
DOIs | |
Publication status | Published - 30 Jun 2023 |
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Dive into the research topics of 'Many-body theory calculations of positron scattering and annihilation in H2, N2, and CH4'. Together they form a unique fingerprint.Projects
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R6997TCP: Many-body Theory of Antimatter Interactions with Atoms, Molecules and Condensed Matter
Green, D. (PI)
29/10/2018 → …
Project: Research
Student theses
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Many-body theory of positron interactions with molecules
Hofierka, J. (Author), Green, D. (Supervisor) & Gruening, M. (Supervisor), Jul 2024Student thesis: Doctoral Thesis › Doctor of Philosophy
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