08 Sep 2023
The TREX School on QMC with TurboRVB took place from 3-7 July 2023 at the Scuola Internazionale Superiore di Studi Avanzati (SISSA) in Trieste, Italy. The school, organized by the TREX project, focused on ab initio quantum Monte Carlo (QMC) methods, known for their high accuracy and versatility in materials and electronic structure calculations.
24 Jul 2023
The TREX Workshop on Code Tuning for the Exascale took place from 05-07 June 2023 at the Slovak Academy of Sciences in Bratislava, Slovakia. The event was a collaboration between the TREX project and the Austrian, Czech, and Slovak National Competence Centres for HPC.
The workshop focused on providing participants with knowledge of code and platform tuning, emphasising parallel programming paradigms (MPI, OpenMP), code optimisation using the MAQAO framework, and efficient platform utilisation, including energy efficiency.
14 Jul 2023
The TREX Workshop on Quantum-Chemical Methods for Strongly Correlated Systems took place from 18-20 April 2023 at the Institute of Physics, Lodz University of Technology in Poland. The workshop aimed to provide participants with an in-depth exploration of the latest developments in electronic structure methods for strongly correlated systems. With a focus on theoretical and computational methods, including high-performance computing and machine learning, the event aimed to enhance participants' understanding and practical skills in this complex field.
16 Jun 2023
A recent publication in the Journal of Chemical Physics, authored by a team of TREX researchers, introduces the TREXIO format and library. TREXIO overcomes challenges faced in wave function theory within quantum chemistry by providing a self-contained format that organizes and stores essential data, eliminating the reliance on external databases.
09 May 2023
On 06-08 March 2023, the third TREX Hackathon was held in Bologna at the premises of TREX partner CINECA. The goal of the hackathon was to get TREX code developers to port their codes to GPUs or optimize their applications already running on GPUs.
26 Apr 2023
Quantum Phase Diagram of High-Pressure Hydrogen: TREX Researchers' Groundbreaking Study Published in Nature Physics
The Nature Physics publication highlights the vital role that theoretical physics and computational methods play together in advancing scientific understanding.
17 Mar 2023
TREX workshop on electronic structure methods for strong correlation: theory, computational algorithms, and codes is taking place from 18-20 April 2023 on the Lodz University of Technology campus.
01 Mar 2023
Successful Workshop on Quantum Monte Carlo with LUMI and TREX CoE: Paving the Way for Future Collaborative Efforts
The TREX Center of Excellence (CoE) and EuroCC National Competence Center Sweden (ENCCS) successfully co-organised a workshop titled "Targeting Chemical Accuracy with Quantum Monte Carlo on LUMI" from January 26-31, 2023.
04 Oct 2022
“Drunk and honest”: TREX CHAMP QMC package presented by the Computational Chemical Physics (CCP) group at University of Twente
Computational Chemical Physics (CCP) group of the University of Twente presented the TREX poster “Drunk and honest: random electrons for accurate excited states and molecular dynamics” at the MESA+ Meeting, which was held at the Kinepolis cinema in Enschede.
15 Jul 2022
The QMC Hands-on Summer Workshop saw 21 Phd and Masters students from Europe and beyond get unique insight into the world of QMC and meet some of the world’s leading experts in the field.
14 Jul 2022
The QMC Hands-on Summer Workshop took place from 20-23 June 2022 in Mojmírovce, Slovakia. The workshop was co-organised by the TREX project, Slovak Academy of Sciences (SAS), Institute of Physics SAS (IPSAS), and the National Competence Centre for High Performance Computing (NCC for HPC).
22 Jun 2022
Five new sites for the next generation of European supercomputers were announced, following the related selection procedure.
02 May 2022
TREX pre-exascale demonstrator applications featured in the EU HPC Centres of Excellence impact brochure
The recently established EuroHPC Joint Undertaking is a joint initiative between the EU, European...
28 Jun 2021
28 Jun 2021
02 Jul 2021
07 Jun 2021
11 May 2021
Luchon Winter School of the Erasmus Mundus held a training event from 25th of January to 8th of February 2021.
The École des Sciences Avancées de Luchon aims to promote the development of advanced sciences and to enhance interdisciplinary exchange between different sciences.
13 Apr 2021
TREX is one of the EC-funded projects aimed to bring together computational and domain scientists, and experts from the HPC and the technology, collaborating to find good solutions which will prepare the TREX applications for the upcoming exascale systems in Europe.
Dirk Pleiter, Professor and Director of PDC at KTH Royal Institute of Technology, provides his perspective on the project and its engineering solutions for exascale.
12 Nov 2020
The 2020 edition of the ETP4HPC Handbook of HPC projects is available. It offers a comprehensive overview over the European HPC landscape that currently consists of around 50 active projects and initiatives. Amongst these is TREX, one of the 14 Centres of Excellence in HPC funded by the European Commission.
21 Oct 2020
Providing the research community with unique exascale computational power instruments to push quantum chemistry simulations a step further
Recently launched under the EU Horizon 2020 Research and Innovation Programme, the TREX is the new HPC Centre of Excellence for quantum chemistry. It tackles the great challenge of enhancing the tools available for the chemistry community to understand the fundamental properties of the matter.