CORDIS Project
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This project focuses on developing advanced computational methods to simulate molecular quantum dynamics, combining electronic structure calculations with quantum treatments of nuclear motion. The aim is to create accurate models that can replace classical simulations with quantum analogs for better understanding of mo…
Many physical and chemical processes in nature as well as an increasing number of man-made devices exploit the quantum properties of electrons, nuclei, and the quantum signatures of the coupling between nuclear and electronic motions.
To optimize the design of novel devices and to correctly interpret physical processes studied, e.g., by experiments probing the molecular dynamics induced by interactions with ultrafast laser pulses, quantitative simulations are required.
Although ninety years have…
ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE
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