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H2 oxidation versus organic substrate oxidation in non-heme iron mediated reactions with H2O2 |
Hassanpour, Azin
; Acuña-Parés, Ferran
; Luis Luis, Josep Maria
; Cussó Forest, Olaf
; Morales de la Rosa, Silvia
; Campos-MartÃn, José Miguel
; Fierro, Jose L.G.
; Costas Salgueiro, Miquel
; Lloret Fillol, Julio
; Mas-Ballesté, Rubén
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2015 |
H2 oxidation versus organic substrate oxidation in non-heme iron mediated reactions with H2O2 |
Hassanpour, Azin
; Acuña-Parés, Ferran
; Luis Luis, Josep Maria
; Cussó Forest, Olaf
; Morales de la Rosa, Silvia
; Campos MartÃn, José Miguel
; Fierro, Jose L.G.
; Costas Salgueiro, Miquel
; Lloret Fillol, Julio
; Mas-Ballesté, Rubén
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2004 |
The hardness profile as a tool to detect spurious stationary points in the potential energy surface |
Torrent Sucarrat, Miquel
; Luis Luis, Josep Maria
; Duran i Portas, Miquel
; Solà i Puig, Miquel
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The hardness profile as a tool to detect spurious stationary points in the potential energy surface |
Torrent Sucarrat, Miquel
; Luis Luis, Josep Maria
; Duran i Portas, Miquel
; Solà i Puig, Miquel
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juliol 2023 |
Implementation of a fast method for the evaluation of the effect of external electric fields on catalysis |
Pey Costa, Guillem
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2002 |
Initial convergence of the perturbation series expansion for vibrational nonlinear optical properties |
Torrent Sucarrat, Miquel
; Solà i Puig, Miquel
; Duran i Portas, Miquel
; Luis Luis, Josep Maria
; Kirtman, Bernard
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Initial convergence of the perturbation series expansion for vibrational nonlinear optical properties |
Torrent Sucarrat, Miquel
; Solà i Puig, Miquel
; Duran i Portas, Miquel
; Luis Luis, Josep Maria
; Kirtman, Bernard
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Iron and Manganese Catalysts for the Selective Functionalization of Arene C(sp2)-H Bonds by Carbene Insertion |
Conde Fernández, Ana
; Sabenya, Gerard
; RodrÃguez, Mònica
; Postils, Verònica
; Luis Luis, Josep Maria
; DÃaz Requejo, M. Mar
; Costas Salgueiro, Miquel
; Pérez, Pedro J.
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Iron and Manganese Catalysts for the Selective Functionalization of Arene C(sp2)-H Bonds by Carbene Insertion |
Conde Fernández, Ana
; Sabeña Vila, Gerard
; RodrÃguez Serrat, Mònica
; Postils, Verònica
; Luis Luis, Josep Maria
; DÃaz Requejo, M. Mar
; Costas Salgueiro, Miquel
; Pérez, Pedro J.
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Isolation of Key Organometallic Aryl-Co(III) Intermediates in Cobalt- Catalyzed C(sp2)−H Functionalizations and New Insights into Alkyne Annulation Reaction Mechanisms |
Planas FÃ brega, Oriol
; Whiteoak, Christopher J.
; Martin- Diaconescu, Vlad
; Gamba, Ilaria
; Luis Luis, Josep Maria
; Parella Coll, Teodor
; Company Casadevall, Anna
; Ribas Salamaña, Xavi
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10 octubre 2016 |
Isolation of Key Organometallic Aryl-Co(III) Intermediates in Cobalt- Catalyzed C(sp2)−H Functionalizations and New Insights into Alkyne Annulation Reaction Mechanisms |
Planas FÃ brega, Oriol
; Whiteoak, Christopher J.
; Martin-Diaconescu, Vlad
; Gamba, Ilaria
; Luis Luis, Josep Maria
; Parella Coll, Teodor
; Company Casadevall, Anna
; Ribas Salamaña, Xavi
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The key role of aromaticity in the structure and reactivity of C60 and endohedral metallofullerenes |
Garcia Borrà s, Marc
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
; Osuna Oliveras, SÃlvia
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5 juny 2018 |
The key role of aromaticity in the structure and reactivity of C60 and endohedral metallofullerenes |
Garcia Borrà s, Marc
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
; Osuna Oliveras, SÃlvia
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15 febrer 2020 |
The key role of aromaticity in the structure and reactivity of C60 and endohedral metallofullerenes |
Garcia Borrà s, Marc
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
; Osuna Oliveras, SÃlvia
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1 novembre 2017 |
The key role of aromaticity in the structure and reactivity of C60 and endohedral metallofullerenes |
Garcia Borrà s, Marc
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
; Osuna Oliveras, SÃlvia
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2006 |
Linear response functions for a vibrational configuration interaction state |
Christiansen, Ove
; Kongsted, Jacob
; Paterson, Martin J.
; Luis Luis, Josep Maria
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Linear response functions for a vibrational configuration interaction state |
Christiansen, Ove
; Kongsted, Jacob
; Paterson, Martin J.
; Luis Luis, Josep Maria
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Maximum aromaticity as a guiding principle for the most suitable hosting cages in endohedral metallofullerenes |
Garcia Borrà s, Marc
; Osuna Oliveras, SÃlvia
; Swart, Marcel
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
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2013 |
Maximum aromaticity as a guiding principle for the most suitable hosting cages in endohedral metallofullerenes |
Garcia Borrà s, Marc
; Osuna Oliveras, SÃlvia
; Swart, Marcel
; Luis Luis, Josep Maria
; Solà i Puig, Miquel
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The Mechanism of Stereospecific CH Oxidation by Fe(Pytacn) Complexes: Bioinspired Non-Heme Iron Catalysts Containing cis-Labile Exchangeable Sites |
Prat Casellas, Irene
; Company Casadevall, Anna
; Postils, Verònica
; Ribas Salamaña, Xavi
; Que, Lawrence
; Luis Luis, Josep Maria
; Costas Salgueiro, Miquel
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2013 |
The Mechanism of Stereospecific CH Oxidation by Fe(Pytacn) Complexes: Bioinspired Non-Heme Iron Catalysts Containing cis-Labile Exchangeable Sites |
Prat Casellas, Irene
; Company Casadevall, Anna
; Postils Ribó, Verònica
; Ribas Salamaña, Xavi
; Que, Lawrence
; Luis Luis, Josep Maria
; Costas Salgueiro, Miquel
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Modeling the cis-Oxo-Labile Binding Site Motif of Non-Heme Iron Oxygenases: Water Exchange and Oxidation Reactivity of a Non-Heme Iron(IV)-Oxo Compound Bearing a Tripodal Tetradentate Ligand |
Company Casadevall, Anna
; Prat Casellas, Irene
; Frisch, Jonathan R.
; Mas-Ballesté, Rubén
; Güell Serra, Mireia
; Juhász, Gergely
; Ribas Salamaña, Xavi
; Münck, Eckard
; Luis Luis, Josep Maria
; Que, Lawrence
; Costas Salgueiro, Miquel
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2011 |
Modeling the cis-Oxo-Labile Binding Site Motif of Non-Heme Iron Oxygenases: Water Exchange and Oxidation Reactivity of a Non-Heme Iron(IV)-Oxo Compound Bearing a Tripodal Tetradentate Ligand |
Company Casadevall, Anna
; Prat Casellas, Irene
; Frisch, Jonathan R.
; Mas-Ballesté, Rubén
; Güell Serra, Mireia
; Juhász, Gergely
; Ribas Salamaña, Xavi
; Münck, Eckard
; Luis Luis, Josep Maria
; Que, Lawrence
; Costas Salgueiro, Miquel
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juny 2015 |
New Cu-based Dyes for application in Dye Sensitized Solar Cells (DSSC), Organic Light Emitting Diodes (OLEDs) and water splitting : an experimental and computational study |
Casademont Reig, Irene
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New Cu-based Dyes for application in Dye Sensitized Solar Cells (DSSC), Organic Light Emitting Diodes (OLEDs) and water splitting : an experimental and computational study |
Casademont Reig, Irene
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