MultiXscale

MultiXscale is a EuroHPC JU Centre of Excellence in multiscale modelling. It is a collaborative 4-year project between the CECAM network and EESSI that will allow domain scientists to take advantage of the computational resources that will be offered by EuroHPC.

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Datasets

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Interaction of a cavitation bubble and a nearby structure

Matevz Dular - University of Ljubljana

Cavitation, a formation of small vapor bubbles inside an initially homogeneous liquid medium, can occur on different complexity scales - the simplest one being a single cavitation bubble. Yet, even here a plethora of phenomena are present.

In the 60', the first recordings of the bubble collapse by a high-speed camera, revealed a formation of high-velocity jets (>100m/s) directed toward the nearby solid surface. These was associated with one of the most ubiquitous issues of cavitation – cavitation erosion, which causes failure of pumps, turbines, marine propellers and even rocket engine turbopumps.

In the talk we will discuss recent developments understanding the interaction of a single cavitation bubble with i) a rigid surface, ii) a compliant structure and iii) the bubble collapse in broken symmetry conditions. The results show a promise of controlli...

Thumbnail of Supporting waLBerla applications in EESSI

Supporting waLBerla applications in EESSI

(Alan O`Cais, University of Barcelona)

Thumbnail of Performance Portability and Scalability of Codes: Kokkos and ALL

Performance Portability and Scalability of Codes: Kokkos and ALL

(Rodrigo Bartolomeu, Jülich Supercomputing Centre)

Thumbnail of Digital twin for ultrasound through OBMD plugin for LAMMPS

Digital twin for ultrasound through OBMD plugin for LAMMPS

(Tilen PotiskNational Institute of Chemistry)

Thumbnail of EESSI CI/CD services for ESPResSo and pyMBE

EESSI CI/CD services for ESPResSo and pyMBE

(Alan O`Cais, University of Barcelona)

Collections

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Modeling & simulation of fluid-structure interactions across scales

In today's world, the modeling and simulation of complex systems span a wide range of disciplines, from biology and chemistry to engineering and beyond. Understanding these systems requires a multiscale approach that integrates knowledge from various levels of organization, from molecular interactions to macroscopic behavior. This approach is crucial for tackling challenges in diverse fields such as bioliquids, energy storage devices, and helicopter dynamics. In the realm of bioliquids, such as biomolecules and cellular components, multiscale modeling plays a pivotal role in unraveling the complexities of biological processes. From protein folding to membrane dynamics, researchers employ techniques ranging from atomistic simulations to coarse-grained models to capture the intricate interplay of molecules within cellular environments. These models not only enhance our fundamental understanding of biological systems but also have practical applications in drug design and personalized medicine. Similarly, the design and optimization of batteries demand a multiscale perspective to address issues ranging from electrode materials to system-level performance. Atomistic simulations provide insights into the behavior of ions and electrons within electrode materials, guiding the development of novel chemistries with enhanced energy storage capabilities. Meanwhile, continuum models facilitate the prediction of battery performance under various operating conditions, aiding in the design of safer and more efficient energy storage devices. In the field of helicopter dynamics, multiscale modeling enables engineers to simulate the interaction between aerodynamics, structural mechanics, and control systems. By integrating these disparate disciplines, engineers can optimize helicopter design for improved performance, maneuverability, and safety. Despite significant advancements, multiscale modeling of complex systems still faces challenges. Bridging the gap between different scales, accurately ...

Thumbnail of Supporting the Development of Multiscale Methods via the European Environment for Scientific Software Installations (EESSI)

Supporting the Development of Multiscale Methods via the European Environment for Scientific Software Installations (EESSI)

The goal of the MultiXscale EuroHPC Centre-of-Excellence is to enable the simulation of hydrodynamics at different length scales, from atomistic to continuum models, on large scale HPC resources like those provided by EuroHPC systems. It will do this via 3 scientific showcases:

Supercapacitor systems for battery applications
Biomedical applications of ultrasound
Simulation of turbulent flows for rotor aeroelastic analyses
The webinar will explore how the European Environment for Scientific Software Installations (EESSI) can accelerate scientific software installations and support multiscale research. This session will provide an introduction to EESSI, followed by in-depth discussions on how the powerful multiscale simulation codes—LAMMPS, waLBerla, and ESPResSo—are being developed via the EESSI framework. ...

Thumbnail of Introduction

Introduction

MultiXscale is a EuroHPC JU Centre of Excellence in multiscale modelling. It is a collaborative 4-year project between the CECAM network and EESSI that will allow domain scientists to take advantage of the computational resources that will be offered by EuroHPC.

The following datasets have been published through this Space and any affiliated Spaces.

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