Related papers: Generalized Extended Lagrangian Born-Oppenheimer M…
We introduce a data-driven method for learning the equations of motion of mechanical systems directly from position measurements, without requiring access to velocity data. This is particularly relevant in system identification tasks where…
The equations of motion of compact binary systems and their associated Lagrangian formulation have been derived in previous works at the third post-Newtonian (3PN) approximation of general relativity in harmonic coordinates. In the present…
The equivalence class of absolute configurations of a system under the group of similarity transformations $Sim(3)$ is called the shape of the system. The $Sim(3)$ invariant Lagrangian of the modified Newtonian theory ensures the existence…
We consider a classical field theory whose equations of motion follow from the least action principle, but the class of admissible trajectories is restricted by differential equations. The key element of the proposed construction is the…
In this article, we consider the extended Kohn-Sham model for atoms subjected to cylindrically-symmetric external potentials. The variational approximation of the model and the construction of appropriate discretization spaces are detailed…
In the framework of Lagrangian formulation, some q-deformed physical systems are considered. The q-deformed Legendre transformation is obtained for the free motion of a non-relativistic particle on a quantum line. This is subsequently…
We present a universal expression for the electronic friction as felt by a set of classical nuclear degrees of freedom (DoF's) coupled to a manifold of quantum electronic DoF's; no assumptions are made regarding the nature of the electronic…
The requirement that both the matter and the geometry of a spacetime canonically evolve together, starting and ending on shared Cauchy surfaces and independently of the intermediate foliation, leaves one with little choice for…
Wavefunction extrapolation greatly reduces the number of self-consistent field (SCF) iterations and thus the overall computational cost of Born-Oppenheimer molecular dynamics (BOMD) that is based on the Kohn-Sham density functional theory.…
A simple mathematical procedure is introduced which allows redefining in an exact way divergent integrals and limits that appear in the basic equations of classical electrodynamics with point charges. In this way all divergences are at once…
We use the functional Renormalisation Group (fRG) to describe the in and out of equilibrium dynamics of stochastic processes, governed by an overdamped Langevin equation. Exploiting the connection between Langevin dynamics and…
We consider a bound system of charged particles moving in an external electromagnetic field, including leading relativistic corrections. The difference from the point particle with a magnetic moment comes from the presence of…
We propose the Lagrangian formulation for describing the motion of a test particle in a general relativistic, stationary, and axially symmetric spacetime. The test particle is also affected by a radiation field, modeled as a coherent flux…
Electronic friction and Langevin dynamics is a popular mixed quantum-classical method for simulating the nonadiabatic dynamics of molecules interacting with metal surfaces, as it can be computationally more efficient than fully quantum…
The time dependence of deviations from the Gaussian state in a freely cooling homogeneous system of smooth inelastically colliding spheres is investigated by kinetic theory. We determine the full time dependence of the coefficients of an…
A new theory for determining the mass function of cosmic structures is presented. It relies on a realistic treatment of collapse dynamics. Gravitational collapse is analyzed in the Lagrangian perturbative framework. Lagrangian perturbations…
We introduce an extension of the Born-Infeld action for a scalar field and show that it can act as unifying-dark-matter, providing an explanation for both structure formation and the accelerated expansion of the universe. We investigate the…
We derive a time-dependent density functional theory appropriate for calculating the near-edge X-ray absorption spectrum in molecules and condensed matter. The basic assumption is to increase the space of many-body wave functions from one…
In this work we give a comprehensive derivation of an exact and numerically feasible method to perform ab-initio calculations of quantum particles interacting with a quantized electromagnetic field. We present a hierachy of…
Non-relativistic de Broglie-Bohm theory describes particles moving under the guidance of the wave function. In de Broglie's original formulation, the particle dynamics is given by a first-order differential equation. In Bohm's…