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We propose another class of magnetic proximity effects based on the spin-dependent hybridization...
An international team of researchers proposes a new type of proximity effect with radical impact in the properties of nonmagnetic materials.
MaX presents its advances on the open-source software Quantum ESPRESSO at the 2023 EuroHPC User Day on 11 December 2023, in Brussels, Belgium.
C. J. Sayers, A. Genco, C. Trovatello, S. Dal Conte, V. O. Khaustov, J. Cervantes-Villanueva, D...
E. Drigo, M. G. Izzo, and S. Baroni
Scientists from NCCR MARVEL led the most comprehensive verification effort so far on computer codes...
Scientists from NCCR MARVEL led the most comprehensive verification effort so far on computer codes for materials simulations, providing their colleagues with a reference dataset and a set of guidelines for assessing and improving existing and future codes.
C. Cardoso, A. T. Costa, A. H. MacDonald, and J. Fernández-Rossier
The work at the ICN2 node focuses on using advanced programming tools to turn SIESTA into a lighthouse exascale-oriented application with enhanced scientific capabilities.
The new TranSIESTA school: Tools for electron transport! Topics covered during the school (may be...
The second meeting of the MaX Centre of Excellence-phase 3 project took place in Barcelona on 16-17 October, hosted by the Catalan Institute of Nanoscience and Nanotechnology (ICN2). The partners reported on the status of ongoing activities in each work package of the project and discussed future steps.
Forschungszentrum Jülich will be home to Europe’s first exascale computer - called JUPITER. The supercomputer is set to be the first in Europe to surpass the threshold of one trillion calculations per second.
E. B. Linscott, N. Colonna, R. De Genanro, N. L. Nguyen, G. Borghi, and A. Ferretti
I. Carnimeo, F. Affinito, S. Baroni, O. Baseggio, L. Bellentani, R. Bertossa, P. D. Delugas, F...
P. Delugas, O. Baseggio, I. Timrov, S. Baroni, and T. Gorni
P. Pegolo, S. Baroni, and F. Grasselli
Explore the theoretical foundations and practical applications of this versatile simulation tool in material science.
MaX partners will meet in Barcelona at Casa Convalecencia, hosted by ICN2, for 2 full days of updates, discussions, and plans for the advancement of the project.
Dario A. Leon, Andrea Ferretti, Daniele Varsano, Elisa Molinari, and Claudia Cardoso
MaX partners will meet in Barcelona @ Casa de la Convalecencia, hosted by ICN2 , for 2 full days of...
A significant step has been taken towards high-throughput computational screening for the discovery...
M. Zanfrognini, M. Bonacci, F. Paleari, E. Molinari, A. Ruini, A. Ferretti, M. J. Caldas, and D...