Related papers: Molecular dynamics modeling of self-diffusion alon…
We study far from equilibrium transport of a periodically driven inertial Brownian particle moving in a periodic potential. As detected recently for a SQUID ratchet dynamics (Spiechowicz J. & Luczka J. Phys. Rev. E 91, 062104 (2015)), the…
This work introduces MiDi, a novel diffusion model for jointly generating molecular graphs and their corresponding 3D arrangement of atoms. Unlike existing methods that rely on predefined rules to determine molecular bonds based on the 3D…
In this work we explore the compositions of non-stoichiometric intermediate phases formed by diffusion reactions: a mathematical framework is developed and tested against the specific case of Nb3Sn superconductors. In the first part, the…
Recent advances in fast sampling methods for diffusion models have demonstrated significant potential to accelerate generation on image modalities. We apply these methods to 3-dimensional molecular conformations by building on the recently…
Ambipolar diffusion (AD) is believed to be a crucial process for redistributing magnetic flux in the dense molecular gas that occurs in regions of star formation. We carry out numerical simulations of this process in regions of low…
As a central part of microstructure evolution, grain boundary (GB) migration is believed to be both monolithic and unidirectional. But here, we introduce the concept of GB decomposition: one GB separates into two new GBs by exerting…
Transport phenomena are studied for a binary (AB) alloy on a rigid square lattice with nearest-neighbor attraction between unlike particles, assuming a small concentration $c_v$ of vacancies $V$ being present, to which $A(B)$ particles can…
We derive the gluon transverse-momentum-dependent (TMD) operator structure of back-to-back quark-antiquark dijet production in deep inelastic scattering at arbitrary Bjorken-x to twist-3 accuracy. Working at leading order in the strong…
Heat transfer to a granular flow is comprised of two resistances in series: near the wall and within the bulk particle bed, neither of which is well understood due to the lack of experimental probes to separate their respective…
We discuss the production of $t\bar t$ quark-antiquark pairs in proton-proton collisions via the $\gamma\gamma$ fusion mechanism. We include topologies in which both protons stay intact or one or even both of them undergo dissociation. The…
We report on grain dynamics versus depth for steady-state gravity-driven flow of grains along a heap formed between two parallel sidewalls. Near the surface the flow is steady and fast, while far below there is no flow whatsoever;…
Rate of grain growth, which aides in achieving desired properties in polycrystalline materials, is conventionally estimated by measuring the size of grains and tracking its change in micrographs reflecting the temporal evolution. Techniques…
Topological lattice defects, such as dislocations and grain boundaries (GBs), are ubiquitously present in the bulk of quantum materials and externally tunable in metamaterials. In terms of robust modes, localized near the defect cores, they…
The tunnelling quantum dynamics of bimodal BJJ system is modified through introducing an equilibrium condition, which is based on the assumption that the BJJ is tend to keep on its ground state (with a lowest energy) during the oscillation.…
We propose a generic uncertainty relationship for cross-diffusion (quasi-soliton) waves triggered by local instabilities through Thermo-Hydro-Mechano-Chemical (THMC) coupling and cross-scale feedbacks. Cross-diffusion waves nucleate when…
A theory for jammed granular materials is developed with the aid of a nonequilibrium steady-state distribution function. The approximate nonequilibrium steady-state distribution function is explicitly given in the weak dissipation regime by…
The diffusion of a system of ferromagnetic dipoles confined in a quasi-one-dimensional parabolic trap is studied using Brownian dynamics simulations. We show that the dynamics of the system is tunable by an in-plane external homogeneous…
It is proposed to consider the fast thermalization of gluons in relativistic heavy-ion collisions as a diffusion process in momentum space. Closed-form analytical solutions of a nonlinear boson diffusion equation (NBDE) with constant drift…
Diffusion-based generative models in SE(3)-invariant space have demonstrated promising performance in molecular conformation generation, but typically require solving stochastic differential equations (SDEs) with thousands of update steps.…
Fast data generation based on Machine Learning has become a major research topic in particle physics. This is mainly because the Monte Carlo simulation approach is computationally challenging for future colliders, which will have a…