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Theoretical approaches to nonequilibrium many-body dynamics generally rest upon an adiabatic assumption, whereby the true dynamics is represented as a sequence of equilibrium states. Going beyond this simple approximation is a notoriously…

软凝聚态物质 · 物理学 2014-10-15 Andrea Fortini , Daniel de las Heras , Joseph M. Brader , Matthias Schmidt

Active Brownian particles display self-propelled movement, which can be modelled as arising from a one-body force. Although their interparticle interactions are purely repulsive, for strong self propulsion the swimmers phase separate into…

软凝聚态物质 · 物理学 2021-03-25 Sophie Hermann , Daniel de las Heras , Matthias Schmidt

Superadiabatic dynamical density functional theory (superadiabatic-DDFT), a first-principles approach based on the inhomogeneous two-body correlation functions, is employed to investigate the response of interacting Brownian particles to…

软凝聚态物质 · 物理学 2023-06-23 S. M. Tschopp , H. D. Vuijk , J. M. Brader

For classical many-body systems subject to Brownian dynamics we develop a superadiabatic dynamical density functional theory (DDFT) for the description of inhomogeneous fluids out-of-equilibrium. By explicitly incorporating the dynamics of…

软凝聚态物质 · 物理学 2022-12-20 S. M. Tschopp , J. M. Brader

We present an explicit and simple approximation for the superadiabatic excess (over ideal gas) free power functional, admitting the study of the nonequilibrium dynamics of overdamped Brownian many-body systems. The functional depends on the…

软凝聚态物质 · 物理学 2018-02-26 Daniel de las Heras , Matthias Schmidt

We investigate motility-induced phase separation of active Brownian particles, which are modeled as purely repulsive spheres that move due to a constant swim force with freely diffusing orientation. We develop on the basis of power…

统计力学 · 物理学 2019-11-13 Sophie Hermann , Philip Krinninger , Daniel de las Heras , Matthias Schmidt

We study dynamic two-body correlation functions, i.e. the two-body density, the current-density correlator or van Hove current, and the current-current correlator in Brownian dynamics computer simulations of a dense Lennard-Jones bulk…

软凝聚态物质 · 物理学 2020-11-04 Thomas Schindler , Matthias Schmidt

We investigated the equilibrium properties of a one-dimensional system of classical particles which interact in pairs through a bounded repulsive potential with a Gaussian shape. Notwithstanding the absence of a proper fluid-solid phase…

软凝聚态物质 · 物理学 2012-01-11 Cristina Speranza , Santi Prestipino , Paolo V. Giaquinta

Consider a fluid composed of two species of particles, where the interparticle pair potentials $u_{11} = u_{22} \neq u_{12}$. On confining an equal number of particles from each species in a cavity, one finds that the average one body…

软凝聚态物质 · 物理学 2007-05-23 A. J. Archer

We present the exact adiabatic theory for the dynamics of the inhomogeneous density distribution of a classical fluid. Erroneous particle number fluctuations of dynamical density functional theory are absent, both for canonical and grand…

软凝聚态物质 · 物理学 2016-05-25 Daniel de las Heras , Joseph M. Brader , Andrea Fortini , Matthias Schmidt

The superadiabatic dynamical density functional theory (superadiabatic-DDFT) is a promising new method for the study of colloidal systems out-of-equilibrium. Within this approach the viscous forces arising from interparticle interactions…

软凝聚态物质 · 物理学 2024-06-10 S. M. Tschopp , J. M. Brader

Optimal performance of thermal machines is reached by suppressing friction. Friction in quantum thermodynamics results from fast driving schemes that generate nonadiabatic excitations. The far-from-equilibrium dynamics of quantum devices…

量子气体 · 物理学 2018-05-01 Shujin Deng , Aurélia Chenu , Pengpeng Diao , Fang Li , Shi Yu , Ivan Coulamy , Adolfo del Campo , Haibin Wu

A new methodology of simulating nonadiabatic dynamics using frozen-width Gaussian wavepackets within the moving crude adiabatic representation with the on-the-fly evaluation of electronic structure is presented. The main feature of the new…

化学物理 · 物理学 2018-04-04 Loïc Joubert-Doriol , Artur F. Izmaylov

We study the dynamical decay of the van Hove function of Brownian hard spheres using event-driven Brownian dynamics simulations and dynamic test particle theory. Relevant decays mechanisms include deconfinement of the self particle, decay…

软凝聚态物质 · 物理学 2022-04-20 Lucas L. Treffenstädt , Thomas Schindler , Matthias Schmidt

We experimentally realize quasistatic adiabatic processes using a single optically-trapped micro- sphere immersed in water whose effective temperature is controlled by an external random electric field. A full energetic characterization of…

统计力学 · 物理学 2015-06-03 Ignacio A. Martínez , Édgar Roldán , Luis Dinis , Dmitri Petrov , Raúl A. Rica

Classical density functional theory (DFT) provides an exact variational framework for determining the equilibrium properties of inhomogeneous fluids. We report a generalization of DFT to treat the non-equilibrium dynamics of classical…

软凝聚态物质 · 物理学 2013-09-06 Matthias Schmidt , Joseph M. Brader

We consider the motion of an overdamped particle in a force field in presence of an external, adiabatic noise, without the restriction that the noise process is Gaussian or the stochastic process is Markovian. We examine the condition for…

统计力学 · 物理学 2007-05-23 Suman Kumar Banik , Jyotipratim Ray Chaudhuri , Deb Shankar Ray

We use computer simulations to study the onset of collective motion in systems of interacting active particles. Our model is a swarm of active Brownian particles with internal energy depot and interactions inspired by the dissipative…

统计力学 · 物理学 2013-05-31 Vladimir Lobaskin , Maksym Romenskyy

We study the driven Brownian motion of hard rods in a one-dimensional cosine potential with an amplitude large compared to the thermal energy. In a closed system, we find surprising features of the steady-state current in dependence of the…

统计力学 · 物理学 2018-10-24 Dominik Lips , Artem Ryabov , Philipp Maass

With the aim of describing real-time electron dynamics, we introduce an adiabatic approximation for the equation of motion of the one-body reduced-density matrix (one-matrix). The eigenvalues of the one-matrix, which represent the…

强关联电子 · 物理学 2012-09-18 Ryan Requist , Oleg Pankratov
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