Extended software development workshop in quantum dynamics

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Extended software development workshop in quantum dynamics

Extended software development workshop in quantum dynamics, University of Durham, 8-19 July 2019: an E-CAM international workshop with local organization by CCPQ members. Quantum molecular dynamics simulations are pivotal to understanding and predicting the microscopic details of molecules, and strongly rely on a combined theoretical and computational effort. The complexity of the underlying equations is such that approximations have to be devised, and the resulting theories need to be translated into algorithms and computer programs for numerical simulations. In the last decades, the joint effort of theoretical physicists and quantum chemists around the challenges of quantum dynamics made it possible to investigate the quantum dynamics of complex molecular systems, with applications ranging from energy conversion, energy storage, organic electronics, light-emitting devices, biofluorescent molecules, or photocatalysis, to name a few. The programme includes science, HPC computational training and joint coding sessions.

July 8, 2019

12:00 pm