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Interatomic Coulombic Electron Capture (ICEC) is an environment-mediated process in which a free electron attaches to a species by transferring excess energy to a neighbor. While previous theoretical investigations assumed fixed nuclei,…

In this work, we present a semiclassical approach to model Intermolecular Coulombic Electron Capture (ICEC) in aqueous solutions using molecular dynamics simulations with OpenMM. We investigate the behavior of an excess electron in the…

Atomic Physics · Physics 2026-03-12 Nicolas Sisourat

The dynamics and processes involved in particle-molecule scattering, including nuclear dynamics, are described and analyzed using various quantum information quantities throughout the different stages of the scattering. The main process…

Quantum Physics · Physics 2025-05-22 Martin Mendez , Federico M. Pont

We recently predicted that the interatomic Coulombic electron capture (ICEC) process, a long-range electron correlation driven capture process, is achievable in gated double quantum dots (DQDs). In ICEC an incoming electron is captured by…

Mesoscale and Nanoscale Physics · Physics 2016-01-20 Federico M. Pont , Annika Bande , Lorenz S. Cederbaum

In the process of interatomic Coulombic electron capture, an incident free electron is captured at an atomic center $A$ and the transition energy is transferred radiationlessly over a rather large distance to a neighboring atom $B$ of…

Atomic Physics · Physics 2024-09-10 L. M. Ellerbrock , A. B. Voitkiv , C. Müller

In interatomic Coulombic electron capture, the capture of a free electron at an atomic center is accompanied by the radiationless transfer of the excess energy to a neighboring atom of different species, leading to ionization of the latter.…

Atomic Physics · Physics 2023-04-19 S. Remme , A. B. Voitkiv , C. Müller

Ultrafast optical techniques allow to study ultrafast molecular dynamics involving both nuclear and electronic motion.To support interpretation, theoretical approaches are needed that can describe both the nuclear and electron…

Computational Physics · Physics 2021-04-14 Thomas Schnappinger , Regina de Vivie-Riedle

We investigate the resonant process of nuclear excitation by electron capture, in which a continuum electron is captured into a bound state of an ion with the simultaneous excitation of the nucleus. In order to derive the cross section a…

Atomic Physics · Physics 2008-11-26 Adriana Pálffy , Zoltán Harman , Werner Scheid

When a vacancy is created in an inner-valence orbital of a dimer of atoms or molecules, the resulting species can undergo interatomic/intermolecular Coulombic decay (ICD): the hole is filled through a relaxation process that leads to a…

Chemical Physics · Physics 2023-05-18 Valentina Parravicini , Thomas-C. Jagau

Alternative methods to calculate neutron capture cross sections on radioactive nuclei are reported using the theory of Inclusive Non-Elastic Breakup (INEB) developed by Hussein and McVoy [1]. The statistical coupled-channels theory proposed…

Nuclear Theory · Physics 2021-03-01 C. A. Bertulani , B. V. Carlson

Electron capture by {\it isolated} atoms and ions proceeds by photorecombination. In this process a species captures a free electron by emitting a photon which carries away the excess energy. It is shown here that in the presence of an {\it…

Quantum Physics · Physics 2010-03-18 Kirill Gokhberg , Lorenz S. Cederbaum

The impact of electron-capture (EC) cross sections on neutron-rich nuclei on the dynamics of core-collapse during infall and early post-bounce is studied performing spherically symmetric simulations in general relativity using a multigroup…

High Energy Astrophysical Phenomena · Physics 2020-01-22 Aurélien Pascal , Simon Giraud , Anthea Fantina , Francesca Gulminelli , Jerome Novak , Micaela Oertel , Adriana Raduta

Electron Capture (EC) cross-section from K, L and M shells of the target atoms to the vacant K, L and M shells of the projectile ions have been calculated by deriving the accurate momentum transfer to the captured electrons for different…

Atomic Physics · Physics 2024-07-03 Sumana Ghosh , Debasis Mitra , Soumya Chatterjee

In the present paper, we study the uncertainties in modeling the collision of complex nuclei (heavy ions) resulting in capture of the nuclei into orbital motion. The effective interaction energy of the nuclei (effective potential) consists…

Nuclear Theory · Physics 2023-05-02 I. I. Gontchar

Molecular mechanisms that enable collective and upconverted energy transfer from multiple photoacceptors to a non-absorbing spectator reaction center are highly desirable for efficient light-energy utilization. Here, we show that…

Chemical Physics · Physics 2026-03-05 Saroj Barik , Pratikkumar Thakkar , Siddhartha S. Payra , Yash Lenka , Y. Sajeev , G. Aravind

Intense light with frequencies above typical atomic or molecular ionization potentials as provided by free-electron lasers couples many photons into extended targets such as clusters and biomolecules. This implies, in contrast to…

Atomic and Molecular Clusters · Physics 2011-05-25 Christian Gnodtke , Ulf Saalmann , Jan-Michael Rost

We provide the experimental evidence that the single electron capture process in slow collisions between O$^{3+}$ ions and neon dimer targets leads to an unexpected production of low-energy electrons. This production results from the…

Excited atoms and molecules can utilize their excess energy to ionize a neighboring system by a process named interatomic and intermolecular Coulombic decay (ICD). ICD is ultrafast, in the femtosecond regime, and has many modes of…

Chemical Physics · Physics 2026-03-10 Alan G. Falkowski , Alexander I. Kuleff , Lorenz S. Cederbaum

The relaxation dynamics of correlated electron transport (ET) along molecular chains is studied based on a substantially improved numerically exact path integral Monte Carlo (PIMC) approach. As archetypical model we consider a Hubbard chain…

Statistical Mechanics · Physics 2009-11-11 L. Muehlbacher , J. Ankerhold , A. Komnik

Efficient excitation of nuclei via exchange of a real or virtual photon has a fundamental importance for nuclear science and technology development. Here, we present a new mechanism of nuclear excitation based on the capture of a free muon…

Nuclear Theory · Physics 2022-10-12 Simone Gargiulo , Ming Feng Gu , Fabrizio Carbone , Ivan Madan
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