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out url icon Recercat 1 juny 2018 Quantifying Aromaticity with Electron Delocalisation Measures
out url icon Recercat 5 juny 2018 Quantifying Aromaticity with Electron Delocalisation Measures Feixas Geronès, Ferran ; Matito i Gras, Eduard ; Poater i Teixidor, Jordi ; Solà i Puig, Miquel
doc icon DUGiDocs 2015 Quantifying Aromaticity with Electron Delocalisation Measures Feixas Geronès, Ferran ; Matito i Gras, Eduard ; Poater i Teixidor, Jordi ; Solà i Puig, Miquel
out url icon Recercat Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases Improta, Roberto ; Santoro, Fabrizio ; Blancafort San José, Lluís
doc icon DUGiDocs 23 març 2016 Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases Improta, Roberto ; Santoro, Fabrizio ; Blancafort San José, Lluís
out url icon Recercat A quick procedure to predict free-edge delamination in thin-ply laminates under tension Guillamet Busquets, Gerard ; Turon Travesa, Albert ; Costa i Balanzat, Josep ; Linde, Peter
out url icon Recercat Rapid determination of polarizability exaltation in fullerene-based nanostructures Swart, Marcel ; Van Duijnen, Piet th.
doc icon DUGiDocs 7 gener 2015 Rapid determination of polarizability exaltation in fullerene-based nanostructures Swart, Marcel ; Duijnen, Petrus Theodorus van‏
out url icon Recercat Reaction Mechanism and Regioselectivity of the Bingel-Hirsch Addition of Dimethyl Bromomalonate to La@C2v-C82 Martínez, Juan Pablo ; Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Poater i Teixidor, Jordi ; Bickelhaupt, F. Matthias ; Solà i Puig, Miquel
doc icon DUGiDocs 2016 Reaction Mechanism and Regioselectivity of the Bingel-Hirsch Addition of Dimethyl Bromomalonate to La@C2v-C82 Martínez López, Juan Pablo ; Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Poater i Teixidor, Jordi ; Bickelhaupt, F. Matthias ; Solà i Puig, Miquel
out url icon Recercat Reaction mechanisms for the formation of mono-and dipropylene glycol from the propylene oxide hydrolysis over ZSM-5 zeolite Horbatenko, Yevhen ; Pérez, Juan Pedro ; Hernández, Pedro ; Swart, Marcel ; Solà i Puig, Miquel
doc icon DUGiDocs 11 setembre 2014 Reaction mechanisms for the formation of mono-and dipropylene glycol from the propylene oxide hydrolysis over ZSM-5 zeolite Horbatenko, Yevhen ; Pérez, Juan Pedro ; Hernández, Pedro ; Swart, Marcel ; Solà i Puig, Miquel
out url icon Recercat The reactivity of endohedral fullerenes: What can be learnt from computational studies? Osuna Oliveras, Sílvia ; Swart, Marcel ; Solà i Puig, Miquel
doc icon DUGiDocs 2011 The reactivity of endohedral fullerenes: What can be learnt from computational studies? Osuna Oliveras, Sílvia ; Swart, Marcel ; Solà i Puig, Miquel
out url icon Recercat Reactivity of an FeIV-Oxo Complex with Protons and Oxidants Hill, Ethan A. ; Weitz, Andrew C. ; Onderko, Elizabeth ; Romero Rivera, Adrián ; Guo, Yisong ; Swart, Marcel ; Bominaar, , Emile L. ; Green, Michael T. ; Hendrich, Michael P. ; Lacy, David C. ; Borovik, A. S.
out url icon Recercat Reactivity and selectivity of bowl-shaped polycyclic aromatic hydrocarbons: Relationship to C60 García-Rodeja, Yago ; Solà i Puig, Miquel ; Bickelhaupt, F. Matthias ; Fenández López, Israel
out url icon Recercat 1 juny 2018 Reactivity and selectivity of bowl-shaped polycyclic aromatic hydrocarbons: Relationship to C60
out url icon Recercat 5 juny 2018 Reactivity and selectivity of bowl-shaped polycyclic aromatic hydrocarbons: Relationship to C60 García-Rodeja, Yago ; Solà i Puig, Miquel ; Bickelhaupt, F. Matthias ; Fenández López, Israel
doc icon DUGiDocs 22 gener 2016 Reactivity and selectivity of bowl-shaped polycyclic aromatic hydrocarbons: Relationship to C60 García-Rodeja, Yago ; Solà i Puig, Miquel ; Bickelhaupt, F. Matthias ; Fenández López, Israel
out url icon Recercat Reducing complexity in polygonal meshes with view-based saliency Castello, Paolo ; Chover, Miguel ; Sbert, Mateu ; Feixas Feixas, Miquel
doc icon DUGiDocs 2014 Reducing complexity in polygonal meshes with view-based saliency Castello, Paolo ; Chover, Miguel ; Sbert, Mateu ; Feixas Feixas, Miquel
out url icon Recercat Regeneration of siloxane-exhausted activated carbon by advanced oxidation processes Cabrera-Codony, Alba ; González Olmos, Rafael ; Martín, María José
out url icon Recercat The Regioselectivity of Bingel-Hirsch Cycloadditions on Isolated Pentagon Rule Endohedral Metallofullerenes Garcia Borràs, Marc ; Cerón, Maira R. ; Osuna Oliveras, Sílvia ; Izquierdo, Marta ; Luis Luis, Josep Maria ; Echegoyen, Luis A. ; Solà i Puig, Miquel
doc icon DUGiDocs 2016 The Regioselectivity of Bingel-Hirsch Cycloadditions on Isolated Pentagon Rule Endohedral Metallofullerenes Garcia Borràs, Marc ; Cerón, Maira R. ; Osuna Oliveras, Sílvia ; Izquierdo, Marta ; Luis Luis, Josep Maria ; Echegoyen, Luis A. ; Solà i Puig, Miquel
out url icon Recercat The response of the electronic structure to electronic excitation and double bond torsion in fulvene: A combined QTAIM, stress tensor and MO perspective Jenkins, Samantha ; Blancafort San José, Lluís ; Kirk, Steven R ; Bearpark, Michael J.
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