For your consideration: This CoEs runtime has ended.
The TREX Center of Excellence (CoE) aims at developing, promoting, and maintaining open-source high-performance software solutions in the field of quantum chemistry, which are ready to take advantage of upcoming exascale architectures. TREX’s ambition is to predict experiments in silico at the nanoscale by means of advanced and systematically improvable stochastic methods targeting the faithful simulation of a fully consistent quantum mechanical electron problem.
To this aim, TREX will exploit and foster the use of supercomputers with energy-efficient accelerators (e.g. GPU) by means of state-of-the-art quantum Monte Carlo (QMC) codes, developed in Europe and internationally recognized as key algorithmic assets.
TREX will facilitate access to the corresponding software suites with high quality documentation and user-friendliness. This will reduce the barrier between advanced numerical simulations and scientific and industrial applications, thus accelerating innovation as well as establishing European leadership in computational science.
The project has been terminated and was in operation from 1 October 2020 until the end of 31 March 2024.
Latest TREX News
FocusCoE at EuroHPC Summit Week 2022
With the support of the FocusCoE project, almost all European HPC Centres of Excellence (CoEs) participated once again in the EuroHPC Summit Week (EHPCSW) this year in Paris, France: the first EHPCSW in person since 2019’s event in Poland.
FocusCoE Hosts Intel OneAPI Workshop for the EU HPC CoEs
On March 2, 2022 FocusCoE hosted Intel for a workshop introducing the oneAPI development environment. In all, over 40 researchers representing the EU HPC Centres of Excellence (CoEs) were able to attend the single day workshop to gain an overview of OneAPI.
CoEs at Teratec Forum 2021 and ISC21
With the support of FocusCoE, a number of HPC CoEs will give short presentations at the virtual PRACE booth in
TREX Project – Interview with Anthony Scemama, CNRS
The TREX Center of Excellence (CoE) aims at developing, promoting, and maintaining open-source high-performance software solutions in the field of quantum chemistry, which are ready to take advantage of upcoming exascale architectures. Antony Scemama, research engineer @CNRS, Toulouse, gives his perspective on the project and its outcomes.
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