Nonlinear electronic stopping of negatively charged particles in liquid water

We present real-time time-dependent density-functional-theory calculations of the electronic stopping power for negative and positive projectiles (electrons, protons, antiprotons, and muons) moving through liquid water. After correction for finite mass effects, the nonlinear stopping power obtained...

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Main Authors: Natalia E. Koval, Fabiana Da Pieve, Bin Gu, Daniel Muñoz-Santiburcio, Jorge Kohanoff, Emilio Artacho
Format: Article
Language:English
Published: American Physical Society 2023-07-01
Series:Physical Review Research
Online Access:http://doi.org/10.1103/PhysRevResearch.5.033063
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author Natalia E. Koval
Fabiana Da Pieve
Bin Gu
Daniel Muñoz-Santiburcio
Jorge Kohanoff
Emilio Artacho
author_facet Natalia E. Koval
Fabiana Da Pieve
Bin Gu
Daniel Muñoz-Santiburcio
Jorge Kohanoff
Emilio Artacho
author_sort Natalia E. Koval
collection DOAJ
description We present real-time time-dependent density-functional-theory calculations of the electronic stopping power for negative and positive projectiles (electrons, protons, antiprotons, and muons) moving through liquid water. After correction for finite mass effects, the nonlinear stopping power obtained in this paper is significantly different from the previously known results from semiempirical calculations based on the dielectric response formalism. Linear-nonlinear discrepancies are found both in the maximum value of the stopping power and the Bragg peak's position. Our results indicate the importance of the nonlinear description of electronic processes, particularly, for electron projectiles, which are modeled here as classical point charges. Our findings also confirm the expectation that the quantum nature of the electron projectile should substantially influence the stopping power around the Bragg peak and below.
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spelling doaj.art-3dea0bdfa2ba420c90149d93f2ad3f042024-04-12T17:32:52ZengAmerican Physical SocietyPhysical Review Research2643-15642023-07-015303306310.1103/PhysRevResearch.5.033063Nonlinear electronic stopping of negatively charged particles in liquid waterNatalia E. KovalFabiana Da PieveBin GuDaniel Muñoz-SantiburcioJorge KohanoffEmilio ArtachoWe present real-time time-dependent density-functional-theory calculations of the electronic stopping power for negative and positive projectiles (electrons, protons, antiprotons, and muons) moving through liquid water. After correction for finite mass effects, the nonlinear stopping power obtained in this paper is significantly different from the previously known results from semiempirical calculations based on the dielectric response formalism. Linear-nonlinear discrepancies are found both in the maximum value of the stopping power and the Bragg peak's position. Our results indicate the importance of the nonlinear description of electronic processes, particularly, for electron projectiles, which are modeled here as classical point charges. Our findings also confirm the expectation that the quantum nature of the electron projectile should substantially influence the stopping power around the Bragg peak and below.http://doi.org/10.1103/PhysRevResearch.5.033063
spellingShingle Natalia E. Koval
Fabiana Da Pieve
Bin Gu
Daniel Muñoz-Santiburcio
Jorge Kohanoff
Emilio Artacho
Nonlinear electronic stopping of negatively charged particles in liquid water
Physical Review Research
title Nonlinear electronic stopping of negatively charged particles in liquid water
title_full Nonlinear electronic stopping of negatively charged particles in liquid water
title_fullStr Nonlinear electronic stopping of negatively charged particles in liquid water
title_full_unstemmed Nonlinear electronic stopping of negatively charged particles in liquid water
title_short Nonlinear electronic stopping of negatively charged particles in liquid water
title_sort nonlinear electronic stopping of negatively charged particles in liquid water
url http://doi.org/10.1103/PhysRevResearch.5.033063
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