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Peláez Ruiz Daniel
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Daniel Peláez Ruiz
Professor of Theoretical Chemistry
I am interested in the theoretical description of molecular systems using a full quantum approach. My main research interests can be summarised in the following axes:
- Characterization of excited electronic states related to photoinduced molecular processes in the presence of non-adiabatic effects.
- Development of algorithms for the characterization of topography of potential energy surfaces.
- Development of algorithms for the description of nuclear quantum dynamics of high-dimensional systems.
- Quantum simulation of the reactivity and theoretical molecular spectroscopy of medium-large systems in the presence of an environment.
I contribute to freely distributed software packages:
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