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doc icon DUGiDocs 15 setembre 2012 On the electronic structure of second generation Hoveyda-Grubbs alkene metathesis precursors Nuñez-Zarur, Francisco ; Poater i Teixidor, Jordi ; Rodríguez Santiago, Luis ; Solans Monfort, Xavier ; Solà i Puig, Miquel ; Sodupe Roure, Mariona
out url icon Recercat On the Mechanism of the Digold(I)-Hydroxide-Catalysed Hydrophenoxylation of Alkynes Gómez-Suárez, Adrián ; Oonishi, Yoshihiro ; Martin, Anthony R. ; Vummaleti, Sai Vikrama Chaitanya ; Nelson, David J. ; Cordes, David B. ; Slawin, Alexandra M. Z. ; Cavallo, Luigi ; Nolan, Steven P. ; Poater Teixidor, Albert
doc icon DUGiDocs 18 gener 2016 On the Mechanism of the Digold(I)-Hydroxide-Catalysed Hydrophenoxylation of Alkynes Gómez-Suárez, Adrián ; Oonishi, Yoshihiro ; Martin, Anthony R. ; Vummaleti, Sai Vikrama Chaitanya ; Nelson, David J. ; Cordes, David B. ; Slawin, Alexandra M. Z. ; Cavallo, Luigi ; Nolan, Steven P. ; Poater Teixidor, Albert
out url icon Recercat On the performance of the Kohn-Sham orbital approach in the calculation of electron transfer parameters. the three state model Butchosa Robles, Cristina ; Simon i Rabasseda, Sílvia ; Blancafort San José, Lluís ; Voityuk, Alexander A.
doc icon DUGiDocs 2014 On the performance of the Kohn-Sham orbital approach in the calculation of electron transfer parameters. the three state model Butchosa Robles, Cristina ; Simon i Rabasseda, Sílvia ; Blancafort San José, Lluís ; Voityuk, Alexander A.
out url icon Recercat On the Reaction Mechanism of the Rhodium-Catalyzed Arylation of Fullerene (C60) with Organoboron Compounds in the Presence of Water Martínez, Juan Pablo ; Solà i Puig, Miquel ; Poater Teixidor, Albert
out url icon Recercat On the Reaction Mechanism of the Rhodium-Catalyzed Arylation of Fullerene (C60) with Organoboron Compounds in the Presence of Water Martínez, Juan Pablo ; Solà i Puig, Miquel ; Poater Teixidor, Albert
out url icon Recercat 1 juny 2018 On the Reaction Mechanism of the Rhodium-Catalyzed Arylation of Fullerene (C60) with Organoboron Compounds in the Presence of Water
out url icon Recercat 5 juny 2018 On the Reaction Mechanism of the Rhodium-Catalyzed Arylation of Fullerene (C60) with Organoboron Compounds in the Presence of Water Martínez López, Juan Pablo ; Solà i Puig, Miquel ; Poater Teixidor, Albert
out url icon Recercat 15 febrer 2020 On the Reaction Mechanism of the Rhodium-Catalyzed Arylation of Fullerene (C60) with Organoboron Compounds in the Presence of Water Martínez López, Juan Pablo ; Solà i Puig, Miquel ; Poater Teixidor, Albert
doc icon DUGiDocs 2015 On the Reaction Mechanism of the Rhodium-Catalyzed Arylation of Fullerene (C60) with Organoboron Compounds in the Presence of Water Martínez López, Juan Pablo ; Solà i Puig, Miquel ; Poater Teixidor, Albert
media icon DUGiMedia 8 juliol 2010 On variational principles in density and density matrix functional theories Levy, Mel
media icon DUGiMedia 5 juliol 2010 Opening Blancafort San José, Lluís ; Calbó Angrill, Josep
out url icon Recercat Open-shell spherical aromaticity: The 2N2 + 2N + 1 (with S = N + 1/2) rule Poater i Teixidor, Jordi ; Solà i Puig, Miquel
doc icon DUGiDocs 2011 Open-shell spherical aromaticity: The 2N2 + 2N + 1 (with S = N + 1/2) rule Poater i Teixidor, Jordi ; Solà i Puig, Miquel
doc icon DUGiDocs 1995 Operator expansion: definition and molecular integral applications Carbó-Dorca, Ramon ; Besalú i Llorà, Emili ; Lobato, Miquel
out url icon Recercat Operator expansion: definition and molecular integral applications Carbó-Dorca, Ramon ; Besalú i Llorà, Emili ; Lobato, Miquel
doc icon DUGiDocs setembre 2016 Optimization of Conical Intersections in Biological Systems with the ONIOM Scheme: Projected Gradient Implementation in the Microiteration Process Escayola Gordils, Sílvia
out url icon Recercat Optimization of Conical Intersections in Biological Systems with the ONIOM Scheme: Projected Gradient Implementation in the Microiteration Process Escayola Gordils, Sílvia
out url icon DUGiDocs 20 maig 2024 Oriented external electric fields in chemistry: development and application of new methods to simulate molecular response properties and reactivity Besalú Sala, Pau
out url icon Recercat Origin and evolution of groundwater collected by a desalination plant (Tordera, Spain): A multi-isotopic approach Otero Pérez, Neus ; Soler i Gil, Albert ; Corp, R.M. ; Mas-Pla, Josep ; Garcia Solsona, E. ; Masqué, P.
doc icon DUGiDocs 24 gener 2011 Origin and evolution of groundwater collected by a desalination plant (Tordera, Spain): A multi-isotopic approach Otero Pérez, Neus ; Soler i Gil, Albert ; Corp, R.M. ; Mas-Pla, Josep ; Garcia Solsona, E. ; Masqué, P.
out url icon Recercat Oxidant-Free Au(I)-Catalyzed Halide Exchange and Csp2-O Bond Forming Reactions Serra i Parareda, Jordi ; Whiteoak, Christopher J. ; Acuña-Parés, Ferran ; Font Molins, Marc ; Luis Luis, Josep Maria ; Lloret Fillol, Julio ; Ribas Salamaña, Xavi
doc icon DUGiDocs 21 octubre 2015 Oxidant-Free Au(I)-Catalyzed Halide Exchange and Csp2-O Bond Forming Reactions Serra Parareda, Jordi ; Whiteoak, Christopher J. ; Acuña-Parés, Ferran ; Font Molins, Marc ; Luis Luis, Josep Maria ; Lloret Fillol, Julio ; Ribas Salamaña, Xavi
doc icon DUGiDocs 2010 Passeig per l’invisible: itinerari químic per la ciutat de Girona = A walk through the invisible: a chemical journey through Girona Duran i Carpintero, Josep
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