Congreso: Pacifichem 2021. virtual (USA) 2021. Título: Understanding AIE with excited state computations Autores: L. Blancafort Congreso: International Conference on Aggregate Science (AIE2021). Guangzhou (CHN) 2021. Título: Understanding AIE with Theory and Computations Autores: L. Blancafort Congreso: International Conference on Theoretical and High Performance Computational Chemistry 2019. Guiyang (CHN) 2019. Título: Computational Studies of Molecular Excited States Autores: L. Blancafort Congreso: 17th Congress International Union of Photobiology and 18th Congress of the European Society for Photobiology. Barcelona (ESP) 2019. Título: Computational studies of photosensitized damage in DNA and beyond Autores: L. Blancafort Congreso: 2019 Materials Research Society Fall Meeting. Boston (USA) 2019. Título: Understanding AIE with Theory and Computations Autores: L. Blancafort Congreso: CECAM meeting: Theoretical and Computational Inorganic Photochemistry: Methodological Developments, Applications and Interplay with Experiments. Toulouse (FRA) 2019. Título: An excited-state picture for photocatalysis on TiO2 surfaces Autores: L. Blancafort Congreso: Ultrafast Science and Technology Spain 2017. Salamanca (ESP) 2017. Título: Computational studies of ultrafast molecular photochemisty and photophysics Autores: L. Blancafort Congreso: Chemiexcitation in Human Disease. Cold spring Harbor Laboratory Conference.. Cold Spring Harbor (NY) (USA) 2017. Título: Cyclobutane dimers and energy wormholes Autores: L. Blancafort Congreso: Excited States Bridging Scales. Marsella (FRA) 2016. Título: Excited state mechanisms in complex systems: From photophysics in solution to photocatalysis on surfaces Autores: L. Blancafort Congreso: Control of Chemical Reactivity: Working Group 3 Meeting of XLIC COST Action CM1204. Birmingham (ENG) 2014. Título: Photophysics of fulvene under the non-resonant Stark effect. Shaping the conical intersection seam Autores: L. Blancafort, S. Ruiz-Barragan Congreso: 2nd Changsha Workshop on Theoretical and Computational Chemistry with Materials. Changsha (CHN) 2013. Título: Photophysics of fulvene derivatives: Aggregation induced emission and optical control Autores: L. Blancafort Congreso: X Girona Seminar on theoretical and computational chemistry for the modeling of biochemical systems. Girona (ESP) 2012. Título: Photochemistry at seams of intersection: From simulation to control Autores: L. Blancafort Congreso: Theoretical Chemistry: Modeling Reactivity from Gas Phase to Biomolecules and Solids. Barcelona (ESP) 2009. Título: Second-order analysis of conical intersections: Applications to photochemistry and photophysics of organic molecules Autores: Blancafort, L.; Lasorne, B.; Bearpark, M. J.; Worth, G. A.; Robb, M. A.
Congreso: XXI European Conference on the Dynamics of Molecular Systems. Toledo (ESP) 2016. Título: Mechanism of Methanol and Water Photocatalytic Dissociation on TiO2(110) Autores: L. Blancafort, A. Migani Congreso: 8th Molecular Quantum Mechanics. Uppsala (SWE) 2016. Título: Triplet Mediated C-N Dissociation vs Internal Conversion in Electronically Excited N-Methylpyrrole Autores: L. Blancafort, V. Ovejas, R. Montero, M. Fernández-Fernández, A. Longarte Congreso: IXth Triennial Congress of the World Association of Theoretical and Computational Chemists (WATOC). Santiago de Compostela (ESP) 2011. Título: Conical intersection optimization with Double Newton-Raphson algorithm Autores: S. Ruiz-Barragan, L. Blancafort Congreso: Femtochemistry 10. Frontiers of ultrafast phenomena in chemistry, physics and biology. Madrid (ESP) 2011. Título: Fulvene excited state dynamics with MCTDH: double bond isomerization Autores: L. Blancafort, F. Gatti, H.-D. Meyer Congreso: IXth Triennial Congress of the World Association of Theoretical and Computational Chemists (WATOC). Santiago de Compostela (ESP) 2011. Título: Fulvene excited state dynamics with MCTDH: double bond isomerization Autores: L. Blancafort, F. Gatti, H.-D. Meyer Congreso: XXIII IUPAC Symposium on Photochemistry. Ferrara (ITA) 2010. Título: Insights into the mechanism of the photoinduced Wolff rearrangement of diazonaphthoquinone Autores: Li, Q.; Migani, A.; Blancafort, L. Congreso: Molecular Quantum Mechanics: From Methylene to DNA and Beyond. Berkeley (USA) 2010. Título: Renner-Teller and conical intersection seams in the intersection space of C2H2+ Autores: Blancafort, L. Congreso: XXIII IUPAC Symposium on Photochemistry. Ferrara (ITA) 2010. Título: Different excited-state hydrogen transfer mechanisms in ortho-nitrobenzaldehyde by ab initio quantum methods Autores: Leyva, V.; González, L.; Corral, I.; González, J.; Feixas, F.; Migani, A.; Blancafort, L. Congreso: 13th International Congress of Quantum Chemistry (ICQC). Helsinki (FIN) 2009. Título: Second-order analysis of conical intersections: Applications to photochemistry and photophysics of organic molecules Autores: Blancafort, L.; Lasorne, B.; Bearpark, M. J.; Worth, G. A.; Robb, M. A. Congreso: Molecular Quantum Mechanics - Analytic Gradients and Beyond. Budapest (HUN) 2007. Título: Analysis of Conical Intersections - Hybrid Optimization Algorithm and Minimum Energy Path in the Intersection Space Autores: Blancafort, L.; Sicilia, F.; Bearpark, M. J.; Robb, M. A. Congreso: XXIII International Conference on Photochemistry. Colònia (DEU) 2007. Título: The mechanism of excited-state intramolecular hydrogen transfer in o-nitrobenzaldehyde by ab initio methods Autores: Feixas, F.; Migani, A.; Blancafort, L. Congreso: XXIII International Conference on Photochemistry. Colònia (DEU) 2007. Título: Structure of the Intersection Space Associated with the Excited-State Intramolecular Proton Transfer in o-Hydroxybenzaldehyde Autores: Migani, A.; Blancafort, L.; Robb, M. A.; DeBellis, A. D. Congreso: XXIII International Conference on Photochemistry (ICP2007). Colonia (DEU) 2007. Título: Thymine photophysics: Structure of the decay path to the ground state Autores: Asturiol, D.; Blancafort, L. Congreso: Radiation Damage in Biomolecular Systems (RADAM '06). Groningen (NLD) 2006. Título: Excited states of stacked nucleobase dimers studied with CASSCF and CASPT2 Autores: Blancafort, L. Congreso: Faraday Discussion 127: 'Non-Adiabatic Effects in Chemical Dynamics'. Oxford (GBR) 2004. Título: Key role of a triple state crossing in the ultrafast decay of electronically excited cytosine Autores: Blancafort, L.; Robb, M. A. Congreso: Multidimensional Quantum Reaction Dynamics 2003. Berlín (DEU) 2003. Título: Surface crossings and dynamics in adiabatic and on-adiabatic Eectron transfer of organic radical cations Autores: Blancafort, L.; Robb, M.A. Congreso: 6th World Congress of Theoretically Oriented Chemists. Lugano (CHE) 2002. Título: Surface crossings and dynamics in adiabatic and on-adiabatic electron transfer of organic radical cations Autores: Blancafort, L.; Robb, M.A.
Congreso: Pacifichem 2021. virtual (USA) 2021. Título: Volume-conserving decay mechanism for GFP chromophore photodynamics Autores: L. Blancafort Congreso: XXXVII Reunión Bienal, Real Sociedad Española de Química. Donosti (ESP) 2019. Título: A volume-conserving coordinate for the excited-state decay of the GFP chromophore Autores: L. Blancafort Congreso: Girona Seminar on Predictive Catalysis. Girona (ESP) 2018. Título: What controls photocatalytic water oxidation on TiO2? Autores: L. Blancafort Congreso: 19th International Conference on Materials for Advanced Technologies. Singapore (SGP) 2017. Título: Restricted Access to a Conical Intersection (RACI) model to explain AIE in organic molecules Autores: L. Blancafort Congreso: 28th International conference on Photochemistry. Strasbourg (FRA) 2017. Título: Photocatalytic oxidation of methanol and water on TiO2(110) - A photochemical perspective Autores: L. Blancafort Congreso: 28th International conference on Photochemistry. Strasbourg (FRA) 2017. Título: Modulating the properties of the GFP chromophore combining theory and experiment Autores: L. Blancafort Congreso: 26th International Conference on Photochemistry. Leuven (BEL) 2013. Título: Photochemistry and photophysics of the amino and imino tautomers of 1-methylcytosine: tautomerisation as a side product of the radiationless decay Autores: L. Blancafort Congreso: Faraday Discussion 163: Photo-initiated Quantum Molecular Dynamics. Nottingham (GBR) 2013. Título: Photophysics of fulvene under the non-resonant Stark effect. Shaping the conical intersection seam Autores: S. Ruiz-Barragan, L. Blancafort Congreso: High-dimensional quantum dynamics: Challenges and opportunities 2012. Birmingham (GBR) 2012. Título: Shaping the conical intersection seam of fulvene with the non-resonant Stark effect Autores: S. Ruiz-Barragan, L. Blancafort Congreso: VIIIth Congress on Electronic Structure, Principles and Applications (ESPA2012). Barcelona (ESP) 2012. Título: Wave packet dynamics at an extended seam of conical intersection: mechanism of the light-induced Wolff rearrangement Autores: Q. Li, A. Migani, L. Blancafort Congreso: XX International Symposium on the Jahn-Teller Effect. Fribourg (CHE) 2010. Título: Connectivity of seam of intersection segments related by permutational symmetry in benzene Autores: Li, Q.; Mendive-Tapia, D.; Paterson, M. J.; Migani, A.; Bearpark, M. J.; Robb, M. A.; Blancafort, L. Congreso: CECAM Workshop on Adiabatic and non-adiabatic methods in quantum dynamics. Lausanne (CHE) 2010. Título: Fulvene excited state dynamics with MCTDH: double bond isomerization Autores: Blancafort, L.; Gatti, F.; Meyer, H.-D. Congreso: Pacifichem 2010 (International Chemical Congress of Pacific Basin Societies). Honolulu (USA) 2010. Título: Exploring the sloped-to-peaked S2/S1 seam of intersection of thymine with electronic structure and direct quantum dynamics calculations Autores: Asturiol, D.; Lasorne, B.; Worth, G. A.; Robb, M. A.; Blancafort, L. Congreso: Pacifichem 2010 (International Chemical Congress of Pacific Basin Societies). Honolulu (USA) 2010. Título: Excited state hydrogen transfer in ortho-nitro benzaldehyde: A correlation diagram translated to a conical intersection cascade Autores: Migani, A.; Leyva, V.; Feixas, F.; Corral, I.; González, L.; Blancafort, L. Congreso: 45th Symposium on Theoretical Chemistry. Neuss (DEU) 2009. Título: Photodynamics of thymine: potential energy surface and quasi-classical dynamics Autores: Blancafort, L.; Asturiol, D.; Lasorne, B.; Robb, M. A. Congreso: XXII IUPAC Symposium on Photochemistry. Gothenburg (SWE) 2008. Título: Photophysical and photochemical processes along extended seams of conical intersections Autores: Blancafort, L. Congreso: XIX International Symposium on the Jahn-Teller Effect . Heidelberg (DEU) 2008. Título: Second-order analysis of conical intersections: Applications to photochmistry and photophysics of organic molecules Autores: Blancafort, L.; Lasorne, B.; Worth, G. A.; Robb, M. A. Congreso: Radiation Damage in Biomolecular Systems (RADAM '07). Dublin (IRL) 2007. Título: Photochemistry and photophysics of DNA nucleobases - Benign and degradative excited-state processes Autores: Blancafort, L. Congreso: Workshop on Theoretical Developments for Radiation Damage. Frejus (FRA) 2007. Título: Photochemistry and photophysics of DNA nucleobases - Benign and degradative excited-state processes Autores: Blancafort, L. Congreso: XXIII International Conference on Photochemistry. Colònia (DEU) 2007. Título: Benign and degradative excited-state processes of DNA nucleobases Autores: Blancafort, L. Congreso: VII Girona Seminar on the Nature of the Chemical Bond. Girona (ESP) 2006. Título: Steric repulsion and aromaticity from a pseudo Jahn-Teller point of view Autores: Blancafort, L. Congreso: International Symposium on the Jahn-Teller Effects 2006. Trieste (ITA) 2006. Título: Second-order analysis of conical intersections: curvature of the seam of conical intersection Autores: Blancafort, L. Congreso: International Chemical Congress of Pacific Basin Societies. Pacifichem 2005 . Honolulu (USA) 2005. Título: Energetics of cytosine singlet excited-state decay paths - a difficult case for CASSCF and CASPT2 Autores: Blancafort, L. Congreso: Pomeranian Quantum Chemistry and Physics Workshop Electronic Structure of Atoms and Molecules.. Pobierowo (POL) 2005. Título: Electron correlation on chemical bonding descriptors Autores: Matito, E.; Poater, J.; Silvi, B.; Blancafort, L..; Duran, M.; Solà, M. Congreso: 20th Symposium on Photochemistry (IUPAC). Granada (ESP) 2004. Título: Key role of a triple state crossing in the ultrafast decay of electronically excited cytosine Autores: Blancafort, L.; Robb, M. A. Congreso: 6th Girona Seminar on Molecular Similarity. Girona (ESP) 2003. Título: A valence-bond-based complete-active-space self-consistent-field method for the evaluation of bonding in organic molecules Autores: Blancafort, L.