News

04 December

A “gold standard” for computational...

Scientists from NCCR MARVEL led the most comprehensive verification effort so far on computer codes for materials...

Training events

13 November to 17 November

TranSIESTA School 2023

Lingby (...

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The new TranSIESTA school: Tools for electron transport!

Topics covered during the school (may be subject to changes):...

News

18 October

MaX project partners gather in Barc...

The second meeting of the MaX Centre of Excellence-phase 3 project took place in Barcelona on 16-17 October,...

News

13 October

Supercomputer JUPITER marks the arr...

Forschungszentrum Jülich will be home to Europe’s first exascale computer - called JUPITER. The supercomputer is set...

News

06 October

A deep dive into material science:...

Explore the theoretical foundations and practical applications of this versatile simulation tool in material...

News

22 September to 21 October

MaX Project Meeting October 2023

MaX partners will meet in Barcelona at Casa Convalecencia, hosted by ICN2, for 2 full days of updates,...

News

09 August

Accelerating material discovering t...

A significant step has been taken towards high-throughput computational screening for the discovery

...

News

12 June to 14 June

MPI and OpenMP in Scientific Softwa...

MaX joins this advanced MPI/OpenMP course, organized by...

News

31 May

Modular structure to enhance effici...

A paper recently published in the Royal Society Open Science journal discusses the...

Event

16 May to 19 May

Workshop on Frontiers in Excited St...

ICTP...

MaX partners are attending the ICTP "Workshop on Frontiers in Excited State Electronic Structure Methods: from Spectroscopy to Photochemistry...

SIESTA school

Training events

02 October to 06 October

First steps with SIESTA: from zero...

online

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SIESTA [1,2] is a multipurpose density-functional code able to perform efficient...

Training events

28 August to 01 September

Advanced Quantum ESPRESSO school: H...

...

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Density functional theory (DFT) is nowadays the main tool for computational modeling of realistic materials from...

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