Maria Ribera Sancho Samso

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CASTIEL´s mission is to contribute to the success of the activities of the National Competence Centres (as realized in the Research and Innovation Action (RIA) in the same call EuroHPC-04-2019 by tackling both the maintenance andstrengthening of excellence, while identifying and closing gaps due to the diverse levels of maturity between the different nations. CASTIEL...

Theoretical Chemistry and Computational Modelling (TCCM) is emerging as a powerful tool to helpin the rational design of new products and materials for pharmaceutical, chemical, energy, computerand new-materials industries. To achieve this goal, it is necessary to go beyond the traditional electronic structure studies, and merge complementary techniques that are normally not...