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The implementation of an efficient self-consistent field (SCF) method including both scalar relativistic effects and spin-orbit interaction in density functional theory (DFT) is presented. We make use of Gaussian-type orbitals (GTOs) and…

Chemical Physics · Physics 2024-05-03 Yannick J. Franzke , Werner M. Schosser , Fabian Pauly

We show that the action of a dynamical system can be supplemented by an effective action for its environment to reproduce arbitrary coordinate dependent ohmic dissipation and gyroscopic forces. The action is a generalization of the harmonic…

Classical Physics · Physics 2024-05-16 Afshin Besharat , Jury Radkovski , Sergey Sibiryakov

The past decade has witnessed the development of systematic effective theories for dissipative thermal systems. Here, we describe an analogous effective theory framework that applies to the classical stochastic dynamics of nonequilibrium…

Statistical Mechanics · Physics 2023-10-20 Xiaoyang Huang , Jack H. Farrell , Aaron J. Friedman , Isabella Zane , Paolo Glorioso , Andrew Lucas

We construct path integrals for stochastic hybrid reaction-diffusion (RD) processes, in which the reaction terms depend on the discrete state of a randomly switching environment. We proceed by spatially discretizing a given RD system and…

Statistical Mechanics · Physics 2021-10-15 Paul C. Bressloff

The reaction-diffusion model can generate a wide variety of spatial patterns, which has been widely applied in chemistry, biology, and physics, even used to explain self-regulated pattern formation in the developing animal embryo. In this…

Numerical Analysis · Mathematics 2020-01-29 Hui Zhang , Xiaoyun Jiang , Fanhai Zeng , George Em Karniadakis

The well-established effective action and effective potential framework from the quantum field theory domain is adapted and successfully applied to classical field theories of the Doi and Peliti type for diffusion controlled reactions.…

Statistical Mechanics · Physics 2008-11-26 David Hochberg , M. -P. Zorzano

We present a new method to renormalize stochastic differential equations subjected to multiplicative noise. The method is based on the widely used concept of effective potential in high energy physics, and has already been successfully…

Statistical Mechanics · Physics 2020-12-29 Jean-Sebastien Gagnon , David Hochberg , Juan Perez-Mercader

We apply a perturbative Doi--Peliti field-theoretical analysis to the stochastic spatially extended symmetric Rock-Paper-Scissors (RPS) and May--Leonard (ML) models, in which three species compete cyclically. Compared to the two-species…

Statistical Mechanics · Physics 2023-05-12 Louie Hong Yao , Mohamed Swailem , Ulrich Dobramysl , Uwe C. Täuber

This article describes Monte-Carlo algorithms for charged systems using constrained updates for the electric field. The method is generalized to treat inhomogeneous dielectric media, electrolytes via the Poisson-Boltzmann equation and…

Statistical Mechanics · Physics 2009-11-10 A. C. Maggs

Electronic polarization and dispersion are decisive actors in determining interaction energies between molecules. These interactions have a particularly profound effect on excitation energies of molecules in complex environments, especially…

Chemical Physics · Physics 2024-12-13 Thomas P. Fay , Nicolas Ferré , Miquel Huix-Rotllant

We apply the operator approach to a stochastic system belonging to a class of death-birth processes, which we introduce utilizing the master equation approach. By employing Doi- Peliti formalism we recast the master equation in the form of…

Statistical Mechanics · Physics 2025-05-02 Edik Ayryan , Ján Buša , Michal Hnatič , Tomáš Lučivjanský , Victor Malyutin

We define an effective action for spin foam models of quantum gravity by adapting the background field method from quantum field theory. We show that the Regge action is the leading term in the semi-classical expansion of the spin foam…

General Relativity and Quantum Cosmology · Physics 2011-11-01 A. Mikovic , M. Vojinovic

Resummations of infinite sets of higher-order perturbative contributions are often needed both in thermal field theory and at zero temperature. For instance, the behaviour of the Standard Model (SM) effective potential extrapolated to very…

High Energy Physics - Phenomenology · Physics 2015-08-03 Apostolos Pilaftsis , Daniele Teresi

A stochastic model is proposed for the acceleration of non-relativistic particles yielding to energy spectra with a shape of a Weibull\textquoteright s function. Such particle distribution is found as the stationary solution of a…

Space Physics · Physics 2016-02-23 G. Pallocchia , M. Laurenza , G. Consolini

We calculate the dynamical spin-spin correlation functions of a Kondo dot coupled to two noninteracting leads held at different chemical potentials. To this end we generalize a recently developed real-time renormalization group method in…

Strongly Correlated Electrons · Physics 2013-01-11 Dirk Schuricht , Herbert Schoeller

The interplay between stochastic chemical reactions and diffusion can generate rich spatiotemporal patterns. While the timescale for individual reaction or diffusion events may be very fast, the timescales for organization can be much…

Statistical Mechanics · Physics 2023-12-12 Schuyler B. Nicholson , Todd R. Gingrich

Starting from the Dirac equation in external electromagnetic and torsion fields we derive a path integral representation for the corresponding propagator. An effective action, which appears in the representation, is interpreted as a…

High Energy Physics - Theory · Physics 2016-12-28 Bodo Geyer , Dmitry Gitman , Ilya Shapiro

Presentation of the probability as an intrinsic property of the nature leads researchers to switch from deterministic to stochastic description of the phenomena. The procedure of stochastization of one-step process was formulated. It allows…

Mathematical Physics · Physics 2016-03-08 M. Hnatich , E. G. Eferina , A. V. Korolkova , D. S. Kulyabov , L. A. Sevastyanov

In this work we write down a classical (not quantum) action for the surface height for the Kardar-Parisi-Zhang (KPZ) equation for surface growth. We do so starting with the regular Martin-Siggia-Rose (MSR) action (which is quantum -…

Statistical Mechanics · Physics 2024-05-06 Garry Goldstein

Using the auxiliary field method, we give an analytical expression for the eigenenergies of a system composed of two non-relativistic particles interacting via a potential of type $\sqrt{a^2 r^2 + b}$. This situation is usual in the case of…

Mathematical Physics · Physics 2009-07-30 Bernard Silvestre-Brac , Claude Semay , Fabien Buisseret