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out url icon Recercat Dispersion Corrections Essential for the Study of Chemical Reactivity in Fullerenes Osuna Oliveras, SĂ­lvia ; Swart, Marcel ; SolĂ  i Puig, Miquel
doc icon DUGiDocs 2011 Dispersion Corrections Essential for the Study of Chemical Reactivity in Fullerenes Osuna Oliveras, SĂ­lvia ; Swart, Marcel ; SolĂ  i Puig, Miquel
out url icon Recercat The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
out url icon Recercat The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
out url icon Recercat The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
out url icon Recercat 2018 June 1 The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes
out url icon Recercat 2018 June 5 The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez LĂłpez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
out url icon Recercat 2020 February 15 The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez LĂłpez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
doc icon DUGiDocs 2016 November 21 The Driving Force of Photoinduced Charge Separation in Metal-Cluster-Encapsulated Triphenylamine-[80]fullerenes MartĂ­nez LĂłpez, Juan Pablo ; SolĂ  i Puig, Miquel ; Voityuk, Alexander A.
out url icon Recercat 2018 June 1 Effect of Incarcerated HF on the Chemical Reactivity of Endohedral HF@C60
out url icon Recercat 2018 June 5 Effect of Incarcerated HF on the Chemical Reactivity of Endohedral HF@C60 Vidal, Sara ; Izquierdo, Marta ; Alom, Shamim ; Garcia BorrĂ s, Marc ; Filippone, Salvatore ; Osuna Oliveras, SĂ­lvia ; SolĂ  i Puig, Miquel ; Whitby, Richard J. ; MartĂ­n, Nazario
out url icon Recercat 2020 February 15 Effect of Incarcerated HF on the Chemical Reactivity of Endohedral HF@C60 Vidal, Sara ; Izquierdo, Marta ; Alom, Shamim ; Garcia BorrĂ s, Marc ; Filippone, Salvatore ; Osuna Oliveras, SĂ­lvia ; SolĂ  i Puig, Miquel ; Whitby, Richard J. ; MartĂ­n, Nazario
doc icon DUGiDocs Effect of Incarcerated HF on the Chemical Reactivity of Endohedral HF@C60 Vidal, Sara ; Izquierdo, Marta ; Alom, Shamim ; Garcia BorrĂ s, Marc ; Filippone, Salvatore ; Osuna Oliveras, SĂ­lvia ; SolĂ  i Puig, Miquel ; Whitby, Richard J. ; MartĂ­n, Nazario
out url icon Recercat Electrochemical control of the regioselectivity in the exohedral functionalization of C60: The role of aromaticity Garcia BorrĂ s, Marc ; Osuna Oliveras, SĂ­lvia ; Swart, Marcel ; Luis Luis, Josep Maria ; SolĂ  i Puig, Miquel
doc icon DUGiDocs 2013 Electrochemical control of the regioselectivity in the exohedral functionalization of C60: The role of aromaticity Garcia BorrĂ s, Marc ; Osuna Oliveras, SĂ­lvia ; Swart, Marcel ; Luis Luis, Josep Maria ; SolĂ  i Puig, Miquel
out url icon Recercat Enantiospecific cis-trans isomerization in chiral fulleropyrrolidines : Hydrogen-bonding assistance in the carbanion stabilization in H2O@C60 Maroto, Enrique E. ; Mateos, Jaime ; Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Filippone, Salvatore ; Herranz, María Ángeles ; Murata, Yasujiro ; Solà i Puig, Miquel ; Martín, Nazario
doc icon DUGiDocs 2015 Enantiospecific cis-trans isomerization in chiral fulleropyrrolidines: Hydrogen-bonding assistance in the carbanion stabilization in H2O@C60 Maroto, Enrique E. ; Mateos, Jaime ; Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Filippone, Salvatore ; Herranz, María Ángeles ; Murata, Yasujiro ; Solà i Puig, Miquel ; Martín, Nazario
out url icon Recercat Essential factors for control of the equilibrium in the reversible rearrangement of M3N@Ih-C80 fulleropyrrolidines: Exohedral functional groups versus endohedral metal clusters Aroua, Safwan ; Garcia BorrĂ s, Marc ; Osuna Oliveras, SĂ­lvia ; Yamakoshi, Yoko
out url icon Recercat Essential factors for control of the equilibrium in the reversible rearrangement of M3N@Ih-C80 fulleropyrrolidines: Exohedral functional groups versus endohedral metal clusters Aroua, Safwan ; Garcia BorrĂ s, Marc ; Osuna Oliveras, SĂ­lvia ; Yamakoshi, Yoko
doc icon DUGiDocs 2014 January 1 Essential factors for control of the equilibrium in the reversible rearrangement of M3N@Ih-C80 fulleropyrrolidines: Exohedral functional groups versus endohedral metal clusters Aroua, Safwan ; Garcia BorrĂ s, Marc ; Osuna Oliveras, SĂ­lvia ; Yamakoshi, Yoko
doc icon DUGiDocs 2023 July Estudi de la reactivitat d’una caixa M@C36 reaccions Diels-Alder Romero del Blanco, Daniel
out url icon Recercat The Exohedral Diels–Alder Reactivity of the Titanium Carbide Endohedral Metallofullerene Ti2C2@D3h-C78: Comparison with D3h-C78 and M3N@D3h-C78 (M=Sc and Y) Reactivity Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Luis Luis, Josep Maria ; Swart, Marcel ; Solà i Puig, Miquel
doc icon DUGiDocs 2012 The Exohedral Diels–Alder Reactivity of the Titanium Carbide Endohedral Metallofullerene Ti2C2@D3h-C78: Comparison with D3h-C78 and M3N@D3h-C78 (M=Sc and Y) Reactivity Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Luis Luis, Josep Maria ; Swart, Marcel ; Solà i Puig, Miquel
out url icon Recercat Extent of charge separation and exciton delocalization for electronically excited states in a triphenylamine-C60 donor–acceptor conjugate: a combined molecular dynamics and TD-DFT study Martínez, Juan Pablo ; Osuna Oliveras, Sílvia ; Solà i Puig, Miquel ; Voityuk, Alexander A.
doc icon DUGiDocs 2015 Extent of charge separation and exciton delocalization for electronically excited states in a triphenylamine-C60 donor–acceptor conjugate: a combined molecular dynamics and TD-DFT study Martínez López, Juan Pablo ; Osuna Oliveras, Sílvia ; Solà i Puig, Miquel ; Voityuk, Alexander A.
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