BOOTHS

Institutional sponsors booths

Building on a tradition of more than 50 years, the CECAM network provides an informal and exciting venue to discuss leading edge topics across all areas of simulation and modelling, train new generations of simulators, foster collaborations among researchers, imagine and carry out scientific project to develop and implement new methods and algorithms.Explore our website for more information and get in touch if you want to collaborate with us!

Mon 13:00-17:00

Tue 09:00-17:00

Wed 09:00-17:00

Thu 09:00-17:00

Presentations of Lhumos, a web portal for educational material for modelling and simulation, jointly developed by CECAM, MARVEL and MaX: Tue-Thu 13:00-14:30

The NCCR MARVEL is a center created by the Swiss National Science Foundation in 2014 which targets the accelerated design and discovery of novel materials, via a materials’ informatics platform of database-driven high-throughput quantum simulations. The research focuses on materials for energy harvesting, storage, and conversion, materials for information-and-communication technologies, and organic crystals/pharmaceuticals. Codes, data and workflows of the project are disseminated through the Materials Cloud platform and the Quantum Mobile virtual machine, both powered by the materials' informatics framework AiiDA.

Presentation of the various codes and activities at the following times:
Tue 12:30-13:15 Chemiscope | AiiDA+AiiDAlab
13:15-14:00 SIRIUS | CP2K
14:00-15:00 IrRep | WannierBerri
12:30-15:00 INSPIRE Potentials – MARVEL Master's Fellowships
Wed 12:45-13:45 SIRIUS | AiiDA + Materials Cloud
13:45-14:45 Koopmans | CP2K
12:45-14:45 INSPIRE Potentials – MARVEL Master's Fellowships
Thu 13:00-14:00 AiiDAlab | AiiDA + Materials Cloud
14:00-15:00 Chemiscope | Koopmans
13:00-15:00 INSPIRE Potentials – MARVEL Master's Fellowships

MaX - MAterials design at the eXascale - is a European Centre of Excellence enabling materials research at the frontiers of HPC. It involves scientists and developers of leading electronic structure codes (including Quantum Espresso, Siesta, cp2k, Yambo, Fleur, BigDFT) and HPC experts to ensure: (1) code porting and performance on multiple and heterogeneous (GPU) HPC architectures, (2) their integration in practical workflows to calculate advanced properties and address exascale and extreme data challenges, (3) co-design activities focused on energy efficiency and exploitation of advanced hardware, (4) new code capabilities enabled by the HPC evolution; (5) community hands-on training and education.

Hours of operation:

Mon 14:00-19:00

Tue 09:00-19:00

Wed 09:00-18:00

Thu 09:00-19:00

Schedule to meet code developers: see details here

Max Happy Hour
Tue 19:15-23:00
(separate registration required, expand for details)

This is a separate event that requires registration:
19:15: gathering, welcome and short overview on MaX results

20:00: buffet dinner

20:30: users meet developers of MaX codes: informal

conversations around dedicated tables. Feel free to come and ask or comment about the last and future advancements of the MaX codes.

Gold sponsors booths

Materials Square is a web based materials and chemistry simulation platform. We provide state-of-the-art simulation methodologies (DFT, MD and CALPHAD) as a service as well as pre/post-process analyze tools. User only pays for computing time (DFT and MD) or number of requests (CALPHAD). No registration/SW installation/annual license fee.

Hours of operation:

Mon 13:00-17:00

Tue 10:00-17:00

Wed 10:00-17:00

Quantum computing promises to help us solve some of humanity’s greatest challenges – and Azure Quantum offers a first-generation quantum computing experience, with access to a diverse range of hardware and simulators to enable the quantum innovation of today to fuel the path toward industrial scale. Delivering impact at a worldwide scale requires breakthroughs across the quantum stack. It requires a truly scalable quantum system that can handle a million qubits and beyond. Our approach to achieving that scale is innovating across every layer of the quantum stack – from software and applications down to control and devices. We’re driving innovation from both directions, simultaneously, in collaboration with a worldwide quantum community coming together to deliver on the promise of quantum.

Hours of operation:

Mon 16:30-17:00

Tue 11:00-11:30 13:30-14:30 16:15-16:45

Wed 11:00-11:30 13:30-14:30 16:15-16:45

Thu 11:00-11:30 13:30-14:30 16:15-16:45

Digital Discovery welcomes both experimental and computational work on digital and automation tools for the acceleration of discovery such as screening, robotics, databases and advanced data analytics, broadly defined, but anchored in chemistry.Faraday Discussions covers a variety of topics in rapidly developing areas of the physical sciences, with a focus on physical chemistry and its interfaces with other scientific disciplines. Physical Chemistry Chemical Physics (PCCP) is an community-owned journal welcoming experimental and theoretical work in physical chemistry, chemical physics and biophysical chemistry.

Hours of operation:

Tue 10:45-11:45 15:45-17:15

Wed 10:45-12:00 15:45-16:45

Thu 10:45-11:45 15:45-17:15

The VASP Software GmbH develops and maintains the Vienna ab initio simulation package, a leading code for quantum mechanical simulations using density functional theory, Hartree-Fock theory, hybrid functionals, as well as beyond mean field theory methods (GW, BSE, RPA, MP2, etc.). Recent developments include on-the-fly machine learning, electron-phonon coupling, improved performance, support for GPUs, updated tutorials and online manuals, and more. A full source code license for academic users can be obtained from www.vasp.at. Commercial licenses are available from Materials Design Inc www.materialsdesign.com.

Hours of operation:

Mon 13:00-19:30

Tue 08:30-19:30

Wed 08:30-18:30

Thu 08:30-19:30