Watch the description by Dr. Marco Marazzi of our work Benzophenone Ultrafast Triplet Population: Revisiting the Kinetic Model by Surface-Hopping Dynamics done in collaboration with Prof. Dr. R. Lindh (Uppsala University, Sweden), Prof. Dr. L. González (University of Vienna, Austria) and Dr. A. Monari (CNRS, France).

Our PhD student Israel González-Ramírez defended the Doctoral Thesis entitled Radiation damage in the DNA/RNA nucleobases: A theoretical study in January, the 29th, 2016

Visit of Dr. Daniel Roca-Sanjuán at the Department of Chemistry at the Universitas Islam Indonesia invited by Prof. Dr. Is Fatimah (November, 16-21, 2015). Dr. Roca-Sanjuán gave several lectures to the undergraduates students on Computational Chemistry and also a talk on the Chemistry of the Excited States.

Oral Defense of Master Theses, July, the 7th, 2015 - Luis Escalera - Fedaa Attana - Tetiana Lemishko (QCEXVAL group) - Meilani K. Wibowo (QCEXVAL group)

Prof. Dr. Russell J. Boyd from the Dalhousie University, Halifax, Canada visited us on April, the 27th, 2015 and gave a conference entitled "From Helium to Hemoglobin and Beyond: Adventures in Computational Chemistry".

ITN Phd Fellowships Call - The European Joint Doctorate in Theoretical Chemistry and Computational Modelling - Initial Training Networks (ITN) (Marie Curie Actions) - Deadline: May, 10th, 2015 - PhD project offered in cotutelle by the University of Groningen (PI: Prof. Remco Havenith) and by the University of Valencia (PI: Dr. Daniel Roca Sanjuan): "ESR2.- Large-scale Modelling of Photo-excitation Processes in Materials with Application in Organic Photovoltaics"

Two-scale Approach: CASPT2/MP2 New approach for calculating dynamic electron correlation effects in large molecular systems using multiconfigurational second order perturbation theory (CASPT2). The method is restricted to cases where partitioning of the molecular system into an active site and an environment is meaningful. Only dynamic correlation effects derived from orbitals extending over the active site are included at the CASPT2 level of theory, whereas the correlation effects of the environment are retrieved at lower computational costs. See P. Farahani et al. JCC, 35, 1609-1617 (2014)

Conference by Gerald H. Pollack University of Washington, Seattle. USA "The fourth phase of water: Beyond solid, liquid, and vapor" XIII Jornada Científica del ICMol 13th December 2013

The Chemistry of Bioluminescence In colaboration with Dr. I. Navizet at Université Paris-Est Marne-la-Vallée, Dr. N. Ferré at Aix-Marseille Université, Dr. Y.-J. Liu at Beijing Normal University, and Prof. Dr. R. Lindh at Uppsala University (Sweden)

See some interesting findings on DNA Photoreactivity

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