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Noble-metal nanoparticles for photocatalysis have become a major research object in recent years due to their plasmon-enhanced strong light-matter interaction. The dynamics of the hot electrons in the noble metal are crucial for the…

The motion of electrons and nuclei in photochemical events often involve conical intersections, degeneracies between electronic states. They serve as funnels for nuclear relaxation - on the femtosecond scale - in processes where the…

Chemical Physics · Physics 2017-08-14 Eirik F. Kjønstad , Henrik Koch

Based on the Thomas-Fermi solution for compressed electron gas around a giant nucleus, $Z\approx 10^6$, we study electric pulsations of electron number-density, pressure and electric fields, which could be caused by an external…

Plasma Physics · Physics 2015-06-16 Hendrik Ludwig , Remo Ruffini , She-Sheng Xue

A unified theoretical description is developed for the formation of an ionized filament channel in a dense-gas medium and the evolution of electronic degrees of freedom in this channel in the laser pulse wake, as illustrated on an example…

Plasma Physics · Physics 2020-07-29 Dmitri A. Romanov , Robert J. Levis

We identify an intriguing feature of the electron-vibrational dynamics of molecular systems via a computational examination of \emph{trans}-polyacetylene oligomers. Here, via the vibronic interactions, the decay of an electron in the…

Quantum Physics · Physics 2013-04-09 Ignacio Franco , Angel Rubio , Paul Brumer

We study the dynamics of a quantum dot embedded in a three-dimensional microcavity in the strong coupling regime in which the quantum dot exciton has an energy close to the frequency of a confined cavity mode. Under the continuous pumping…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 J. I. Perea , D. Porras , C. Tejedor

Light excitation of a semiconductor, known to dynamically-polarize the nuclear spins by hyperfine contact interaction with the photoelectrons, also generates an intrinsic nuclear depolarization mechanism. This novel relaxation process…

Quantum Physics · Physics 2009-11-13 Daniel Paget , Thierry Amand , J. P. Korb

Non-adiabatic dynamics and conical intersections play a central role in the chemistry of most polyatomic molecules, ranging from isomerization to heterocyclic ring opening and avoided photo-damage of DNA. Studying the underpinning…

Chemical Physics · Physics 2024-11-07 S. Severino , K. M. Ziems , M. Reduzzi , A. Summers , H. -W. Sun , Y. -H. Chien , S. Gräfe , J. Biegert

This paper describes the effects of electronic nonequilibrium in a simulation of ultrafast laser irradiation of materials. The simulation scheme based on tight-binding molecular dynamics, in which the electronic populations are traced with…

Materials Science · Physics 2023-12-29 Nikita Medvedev

Electronic coherences can be leveraged to control molecular dynamics, but such control is limited by ultrafast decoherence driven by coupling between electronic excitations and molecular vibrations. With the goal of understanding and…

Chemical Physics · Physics 2025-05-27 Jiří Suchan , Benjamin G. Levine

Two-dimensional electronic spectroscopy (2DES) provides rich information about how the electronic states of molecules, proteins, and solid-state materials interact with each other and their surrounding environment. Atomistic molecular…

The time-dependent Schr\"{o}dinger equation for the hydrogen atom and its interaction with coherent intense high-frequency short laser pulses is solved numerically exactly by propagating the single-electron wave packets. Thereby, the…

Atomic Physics · Physics 2013-09-11 Philipp V. Demekhin , David Hochstuhl , Lorenz S. Cederbaum

Density inhomogeneities are ubiquitous in space and astrophysical plasmas, in particular at contact boundaries between different media. They often correspond to regions that exhibits strong dynamics on a wide range of spatial and temporal…

Plasma Physics · Physics 2021-08-04 F. Lavorenti , P. Henri , F. Califano , S. Aizawa , N. André

The interaction between electronic and nuclear degrees of freedom in single-molecule junctions is an essential mechanism, which may result in the current-induced rupture of chemical bonds. As such, it is fundamental for the stability of…

Mesoscale and Nanoscale Physics · Physics 2020-11-25 André Erpenbeck , Yaling Ke , Uri Peskin , Michael Thoss

The competition between electron localization and de-localization in Mott insulators underpins the physics of strongly-correlated electron systems. Photo-excitation, which re-distributes charge between sites, can control this many-body…

Strongly Correlated Electrons · Physics 2015-08-05 S. Wall , D. Brida , S. R. Clark , H. P. Ehrke , D. Jaksch , A. Ardavan , S. Bonora , H. Uemura , Y. Takahashi , T. Hasegawa , H. Okamoto , G. Cerullo , A. Cavalleri

The dynamics of molecular electron excitation and ionisation is studied in real-time for ultra-short IR laser pulses of intensity I>10^{13} W/cm^{2}. The multi-electron molecule is modeled by a system of two active electrons moving in a…

Optics · Physics 2015-06-26 A. I. Pegarkov

Understanding nonequilibrium electron-phonon interactions at the microscopic level and on ultrafast timescales is a central goal of modern condensed matter physics. Combining time- and angle-resolved extreme ultraviolet photoemission…

There has been rapid development of systems that yield strong interactions between freely propagating photons in one dimension via controlled coupling to quantum emitters. This raises interesting possibilities such as quantum information…

Nonstationary molecular states which contain electronic coherences can be impulsively created and manipulated by using recently-developed ultrashort optical and X-ray pulses via photoexcitation, photoionization and Auger processes. We…

Chemical Physics · Physics 2015-09-02 Konstantin E. Dorfman , Kochise Bennett , Shaul Mukamel

The extension of coherent $\omega$-$2\omega$ control schemes, recently implemented in free-electron lasers (FELs), to molecular systems offers new opportunities to control chemical dynamics on the electronic timescale, potentially allowing…