The excellent performance of CRYSTAL MPP allows users to successfully compete to access high supercomputing resources within international projects.
CRYSTAL MPP has been recently used in large scale projects granted with millions of CPU hours within the
PRACE initiative:
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Mesoporous silica for drug delivery: a quantum mechanical simulation
Project leader: Piero Ugliengo, Università di Torino - Dip. Chimica, Italy
Resource awarded: 20000000 core hours on SuperMUC (GCS@LRZ, Germany)
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Ab initio modelling of the adsorption in giant Metal-Organic Frameworks: from small molecules to drugs
Project leader: Civalleri Bartolomeo; University of Torino, ITALY
Resource awarded: 40000000 core hours on SuperMUC (GCS@LRZ, Germany)
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SAMC - Symmetry-Adapted Monte Carlo for ab initio modeling of disordered crystalline materials Project leader: Philippe D'Arco, Université Pierre et Marie Curie, FR
Resource Awarded: 20000000 core hours on HERMIT (HRLS, Germany)
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Towards a modeling of realistic quantum dots/graphene-based photovoltaic devices using DFT
Project Leader: Frédéric Labat, Chimie ParisTech, FR
Resource Awarded: 20000000 core hours on CURIE Thin Nodes (TN)