Enabling frontier HPC in the materials domain
MaX Centre of Excellence for Materials at the eXascale
European Centre of Excellence in HPC
Welcome to our August update! Enjoy reading this month's issue packed with:
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MaX lighthouse codes illuminate the materials simulation community across the world
The MaX lighthouse codes (Quantum EESPRESSO, SIESTA, YAMBO, FLEUR, and BigDFT) implement state-of-the-art quantum mechanical materials simulations, based on Density Functional Theory and beyond.?Today, our codes are adopted by a large number of end users across the world (see maps above), also thanks to our efforts in making the codes available and efficient on different architectures including heterogeneous architectures based on GPUs. MaX codes are largely modular and utilize modern programming paradigms, leveraging highly tuned libraries and computational kernels. Discover more by visiting the MaX lighthouse software environments.
? Past Training | 19-21 June 2024 | Online
“Materials and molecular modelling with Quantum ESPRESSO”
Online school organized by MaX, in collaboration with: NCC Czechia, NCC Austria, NCC Slovenia, NCC Slovakia, NCC Poland and NCC Hungary. Held between 19-21 June 2024, the online school focused on the MaX lighthouse code QUANTUM ESPRESSO.? The school gathered 46 attendees with a background in condensed matter physics and chemistry. More information and the complete programme: Info & Agenda. Recordings and course material available at: EuroCC Czechia school page.
? Upcoming Event | 22-27 September, 2024 | Prague, Czech Republic
MaX will sponsor the 11th International Conference on Multiscale Materials Modeling (MMM-11)
The International Conference on Multiscale Materials Modeling (MMM) focuses on computational materials science, embracing existing and emerging methods from interdisciplinary fields inherent to complex material systems. Hosted by the Institute of Physics of Materials of the Czech Academy of Sciences, the 2024 Conference will feature MaX among its sponsors together with a talk by MaX partner Pablo Ordejon (ICN2) on “QM/MM simulations of the electrochemical interface”. Learn more about the keynote lectures and the contributed talks in the conference programme.
领英推荐
? Upcoming Event | 24-25 October, 2024 | Bremen, Germany
MaX partners meet in Bremen
To be held in the UNESCO World Heritage city of Bremen, the event will gather MaX partners to discuss WP advancements and several critical topics such as benchmarking, deployment, and profiling of the MaX flagship codes.?Further information and registration form are available on the MaX website at the dedicated event page (registration deadline: Friday, September 6, 2024). We look forward to meeting you in Bremen!
? Upcoming Training | 16-20 September, 2024 | Online
Picking Flowers - a Hands-on FLEUR Tutorial (2024 edition)
Tailored to both new and more experienced users of the MaX lighthouse code FLEUR, the hands-on tutorial will consist of practical sessions and discussions with the FLEUR code developers. Details and registration are available on the dedicated website.
Happening in the EuroHPC ecosystem...
? Upcoming Training | 4 October, 2024 | Online
Sprint Training Event: Introduction to EESSI – European Environment for Scientific Software Installations
Organized by NCC Austria and NCC Slovenia, together with CoE MultiXscale. Held online on 4 October 2024, the workshop will present EESSI, how to get access to it, and how to use it with practical demonstrations. Register at this link. More information available on the event page.?
Stay up to date with MaX!
MAX regularly organizes and participates in several initiatives such as conferences, workshops, professional and educational activities targeted to the materials and the HPC communities.?
?? Visit our agenda and stay up to date with all upcoming events and trainings!