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    About MAX

    MAX (MAterials design at the eXascale) is a European Centre of Excellence which enables materials modelling, simulations, discovery and design at the frontiers of the current and future High Performance Computing (HPC), High Throughput Computing (HTC) and data analytics technologies.

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    The software developed by MAX is made available to the whole community in open-source form. In this section you can find our main software output and how to obtain it.
     

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    MAX addresses the challenges of porting, scaling, and optimising material science application codes for the peta- and exascale platforms in order to deliver best code performance and improve users productivity on the upcoming architectures.

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    MAX is committed in supporting data stewardship by adhering to the FAIR-sharing principles. High-quality data is provided both in the format of curated scientific results and raw data, focusing on the tracking of provenance to ensure the full reproducibility of results.

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    MAX develops and offers services and technical support dedicated to the general public and the expert users from both industry and academia.

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    MAX offers integrated training and education in the field of HPC developments and in the computational materials science domain, including workshops and schools, contributions to University courses and training through research in the CoE labs.

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    • FAQ
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January 7, 2020

Perfluorinated Self-Assembled Monolayers Enhance the Stability and Efficiency of Inverted Perovskite Solar Cells

Perovskite solar cells are among the most exciting photovoltaic systems as they combine low...


January 7, 2020

Perfluorinated Self-Assembled Monolayers Enhance the Stability and Efficiency of Inverted Perovskite Solar Cells

C.M. Wolff, L. Canil, C. Rehermann, N.N. Linh, F.S. Zu, M. Ralaiarisoa, P. Caprioglio, L. Fiedler,...


January 2, 2020

Ultrafast charge ordering by self-amplified exciton-phonon dynamics in TiSe2

C. Lian, S.J. Zhang, S.Q. Hu, M.X. Guan, and S. Meng


January 1, 2020

Topological frustration induces unconventional magnetism in a nanographene

S. Mishra, D. Beyer, K. Eimre, S. Kezilebieke, R. Berger, O. Gruening, C.A. Pignedoli, K. Muellen,...


December 19, 2019

MaX Highlights on 2019 Summer School and Workshops

In 2019, MaX organised several workshops, training and school in partnership with the relevant organisations in HPC, HTC and materials modelling which were offered to scientific, academic, industrial communities and the general public.


December 18, 2019

Superionic conductivity in lithium argyrodite solid-state electrolyte by controlled Cl-doping

The lithium ion conductivity of lithium argyrodite can be improved by introducing Cl to tailor the...


December 12, 2019

MaX in a nutshell

Take a look at our short video! Materials shaped human civilization, impacting the evolution of the...


December 9, 2019

MaX Flyer

The MaX official flyer, download a copy now!


December 9, 2019

OPEN POSITION @SISSA

SISSA , the International School for Advanced Studies in Trieste, in collaboration with the EU MaX...


December 9, 2019

Open position @ SISSA

SISSA , the International School for Advanced Studies in Trieste, in collaboration with the EU MaX...


December 9, 2019

Topological frustration induces unconventional magnetism in a nanographene

The chemical versatility of carbon imparts manifold properties to organic compounds, where...


December 6, 2019

Rudolf Zeller


December 6, 2019

Samir Lounis


December 6, 2019

Fulvio Paleari


November 27, 2019

AiiDA Hackathon: developing code plugins and robust scientific workflows@CINECA

Where: CINECA (Bologna, IT) Who (in-charge): ICN2, EPFL, CINECA What: Hackathon When: 17-21/02/2020


November 27, 2019

Computational School on Electronic Excitations in Novel Materials Using the Yambo Code

Where: ICTP (Trieste, IT) Who (in-charge): CNR, ICTP What: School When: 27-31/01/2020


November 19, 2019

Separation of concerns

With the increasing hardware diversity comes an increasing need for software adaptation and...


November 18, 2019

Zirconium nitride catalysts surpass platinum for oxygen reduction

Platinum (Pt)-based materials are important components of microelectronic sensors, anticancer drugs...


November 12, 2019

Join MaX @ SC19

Mark your calendar, as MaX we'll be present at Supercomputing 2019 in Denver, Colorado. Two of our...


November 11, 2019

R&D INNOVATION CONFERENCE 2019

R&D Innovation Conference 2019 brings together R&D leaders, experts, VPs, and CxOs will take place in Amsterdam, Netherlands on 12-13 November 2019.


November 8, 2019

MaX Hackathon: Domain Specific Libraries for Materials Modelling

MaX CoE organized a Hackathon which will be held in Trieste @ICTP from November 25th to November...


November 7, 2019

MaX Hackathon: Domain Specific Libraries for Materials Modelling

The MaX CoE will organize an Hackathon which will be held in ICTP - Trieste from November 25th to November 29th.


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MaX - Materials design at the Exascale has received funding from the European High Performance Computing Joint Undertaking and Participating Countries in Project (Czechia, France, Germany, Italy, Slovenia and Spain) under grant agreement no. 101093374.

Views and opinions expressed are however those of the author(s) only and do not necessarily reflect those of the European High Performance Computing Joint Undertaking. Neither the European Union nor the granting authority can be held responsible for them.

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