Quantum molecular modeling of complex molecular systems is an indispensable and integrated component in advanced material design, as such simulations provide a microscopic insight into the underlying physical processes. ENCCS and PDC will offer training on using the VeloxChem program package. We will highlight its efficient use on modern HPC architectures, such as the Dardel system at PDC and the pre-exascale supercomputer LUMI, 50% of which is available to academic users of the consortium states, including Sweden and Denmark. This event is for researchers and students already familiar with quantum chemistry that want to learn how to:
In this workshop, you will learn how to use the VeloxChem program package to:
We assume that participants have:
For questions regarding this event please contact us at firstname.lastname@example.org.
For updated agenda please visit the event's page at https://enccs.se/events/events-2022-march-veloxchem-workshop/
This training is intended for users established in the European Union or a country associated to Horizon 2020.