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Nuclear quantum effects and non-Born--Oppenheimer effects play a vital role in many chemical and biological processes, motivating the incorporation of such effects into dynamical simulations. In real-time nuclear--electronic orbital…

Chemical Physics · Physics 2026-05-27 Nicholas J. Boyer , Sharon Hammes-Schiffer

Classical mechanics and Time Dependent Hartree-Fock (TDHF) calculations of heavy ions collisions are performed to study the rotation of a deformed nucleus in the Coulomb field of its partner. This reorientation is shown to be independent on…

Nuclear Theory · Physics 2009-11-10 Cedric Simenel , Philippe Chomaz , Gilles De France

The electric microfield distribution at charged particles is studied for two-component electron-ion plasmas using molecular dynamics simulation and theoretical models. The particles are treated within classical statistical mechanics using…

Plasma Physics · Physics 2009-11-11 H. B. Nersisyan , C. Toepffer , G. Zwicknagel

We use non-linear gauge-invariant perturbation theory to study the interaction of an inflation produced seed magnetic field with density and gravitational wave perturbations in an almost Friedmann-Lema\^itre-Robertson-Walker (FLRW)…

General Relativity and Quantum Cosmology · Physics 2012-10-23 Bishop Mongwane , Peter K. S. Dunsby , Bob Osano

The interaction of strong laser fields with matter intrinsically provides powerful tools to image transient dynamics with an extremely high spatiotemporal resolution. Here, we study strong-field ionisation of laser-aligned molecules and…

The study of electronic transitions within a molecule connected to the absorption or emission of light is a common task in the process of the design of new materials. The transitions are complex quantum mechanical processes and a detailed…

Human-Computer Interaction · Computer Science 2021-06-03 Talha Bin Masood , Signe Sidwall Thygesen , Mathieu Linares , Alexei I. Abrikosov , Vijay Natarajan , Ingrid Hotz

We investigate the nonlinear interaction between a relativistically strong laser beam and a plasma in the quantum regime. The collective behavior of the electrons is modeled by a Klein-Gordon equation, which is nonlinearly coupled with the…

Plasma Physics · Physics 2011-07-26 Bengt Eliasson , Padma K. Shukla

Hamiltonian light-front quantum field theory provides a framework for calculating both static and dynamic properties of strongly interacting relativistic systems. Invariant masses, correlated parton amplitudes and time-dependent scattering…

Nuclear Theory · Physics 2014-06-10 James P. Vary , Xingbo Zhao , Anton Ilderton , Heli Honkanen , Pieter Maris , Stanley J. Brodsky

In this theoretical study, the problem of self-focusing of an X-ray intense laser beam in the thermal quantum plasma is studied. Using a relativistic fluid model and taking into account the hydrodynamic pressure of degenerate electrons in…

We present the formalism of Time-dependent Exchange Perturbation Theory (TDEPT) built to all orders of perturbation, for the arbitrary time dependency of perturbation. The theory takes into account the rearrangement of electrons among…

Quantum Physics · Physics 2015-04-13 Elena V. Orlenko , Tatiana Latychevskaia , Alexandr V. Evstafev , Fedor E. Orlenko

A simple formula is obtained for coupling electrons in a complex system to the electromagnetic field. It includes the effect of intra-atomic excitations and nuclear motion, and can be applied in. e.g., first-principles-based simulations of…

Quantum Physics · Physics 2009-11-13 Roland E. Allen

We present theoretical models for the time-dependent voltage of an electrochemical cell in response to a current step, including effects of diffuse charge (or "space charge") near the electrodes on Faradaic reaction kinetics. The full model…

Chemical Physics · Physics 2015-05-14 M. van Soestbergen , P. M. Biesheuvel , M. Z. Bazant

Quantum material systems upon applying ultrashort laser pulses provide a rich platform to access excited material phases and their transformations that are not entirely like their equilibrium counterparts. The addressability and potential…

Strongly Correlated Electrons · Physics 2021-08-19 Xiaoyi Sun , Shuaishuai Sun , Chong-Yu Ruan

We explore the two-dimensional motion of relativistic electrons when they are trapped in magnetic fields having spatial power-law variation. Its impacts include lifting of degeneracy that emerged in the case of the constant magnetic field,…

Quantum Physics · Physics 2023-04-05 Srishty Aggarwal , Banibrata Mukhopadhyay

The spin of an electron trapped in a quantum dot is a promising candidate implementation of a qubit for quantum information processing. We study the central spin problem of the effect of the hyperfine interaction between such an electron…

Mesoscale and Nanoscale Physics · Physics 2007-08-29 Gang Chen , Doron L. Bergman , Leon Balents

We study the physical electron in quantum electrodynamics expanded on the light-cone Fock space in order to address two problems: (1) the physics of the electron's anomalous magnetic moment $a_e$ in nonperturbative QED, and (2) the…

High Energy Physics - Phenomenology · Physics 2009-09-11 John R. Hiller , Stanley J. Brodsky

We examine the non-perturbative gauge dependence of arbitrary configuration space fermion correlators in quantum electrodynamics (QED). First, we study the dressed electron propagator (allowing for emission or absorption of any number of…

High Energy Physics - Theory · Physics 2021-07-21 Naser Ahmadiniaz , James P. Edwards , José Nicasio , Christian Schubert

Maxwell theory is usually treated in the lab frame under the standard time order (light-signal clock synchronization). Particle tracking in the lab frame usually treats time as an independent variable. Then, the evolution of electron beams…

Accelerator Physics · Physics 2022-02-17 Gianluca Geloni , Vitali Kocharyan , Evgeni Saldin

The ionization dynamics of a hydrogen molecule, serving as a fundamental benchmark in quantum chemistry, is investigated within a comprehensive framework combining quantum electrodynamics and the Lindblad master equation. This approach…

Quantum Physics · Physics 2025-11-27 Hui-hui Miao

Electron quantum path interferences in strongly laser-driven aligned molecules and their dependence on the molecular alignment is an essential open problem in strong-field molecular physics. Here, we demonstrate an approach which provides…

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