Listing items by Author "Ruiz-Barragán, Sergi"

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doc icon DUGiDocs 2013 Conical intersection optimization based on a double Newton-Raphson algorithm using composed steps Ruiz-Barragán, Sergi ; Robb, Michael A. ; Blancafort San José, Lluís
out url icon Recercat Conical intersection optimization based on a double Newton-Raphson algorithm using composed steps Ruiz-Barragán, Sergi ; Robb, Michael A. ; Blancafort San José, Lluís
doc icon DUGiDocs 2015 April 14 Conical intersection optimization using composed steps inside the ONIOM(QM:MM) scheme: CASSCF:UFF implementation with microiterations Ruiz-Barragán, Sergi ; Morokuma, Keiji ; Blancafort San José, Lluís
out url icon Recercat Conical intersection optimization using composed steps inside the ONIOM(QM:MM) scheme: CASSCF:UFF implementation with microiterations Ruiz-Barragán, Sergi ; Morokuma, Keiji ; Blancafort San José, Lluís
doc icon DUGiDocs 2016 September 1 The excited-state structure, vibrations, lifetimes, and nonradiative dynamics of jet-cooled 1-methylcytosine Trachsel, Maria A. ; Wiedmer, Timo ; Blaser, Susan ; Frey, Hans-Martin ; Li, Quansong ; Ruiz-Barragán, Sergi ; Blancafort San José, Lluís ; Leutwyler, Samuel
out url icon Recercat The excited-state structure, vibrations, lifetimes, and nonradiative dynamics of jet-cooled 1-methylcytosine Trachsel, Maria A. ; Wiedmer, Timo ; Blaser, Susan ; Frey, Hans-Martin ; Li, Quansong ; Ruiz-Barragán, Sergi ; Blancafort San José, Lluís ; Leutwyler, Samuel
out url icon Recercat The excited-state structure, vibrations, lifetimes, and nonradiative dynamics of jet-cooled 1-methylcytosine Trachsel, Maria A. ; Wiedmer, Timo ; Blaser, Susan ; Frey, Hans-Martin ; Li, Quansong ; Ruiz-Barragán, Sergi ; Blancafort San José, Lluís ; Leutwyler, Samuel
out url icon Recercat 2018 June 5 The excited-state structure, vibrations, lifetimes, and nonradiative dynamics of jet-cooled 1-methylcytosine Trachsel, Maria A. ; Wiedmer, Timo ; Blaser, Susan ; Frey, Hans-Martin ; Li, Quansong ; Ruiz-Barragán, Sergi ; Blancafort San José, Lluís ; Leutwyler, Samuel
doc icon DUGiDocs 2014 September 19 Modelling of potential energy surfaces for photochemistry: conical intersections and application to optical control Ruiz-Barragán, Sergi
doc icon TDX 2014 September 19 Modelling of potential energy surfaces for photochemistry: conical intersections and application to optical control Ruiz-Barragán, Sergi
out url icon Recercat Modelling of potential energy surfaces for photochemistry: conical intersections and application to optical control Ruiz-Barragán, Sergi
doc icon DUGiDocs 2013 Photophysics of fulvene under the non-resonant stark effect: shaping the conical intersection seam Ruiz-Barragán, Sergi ; Blancafort San José, Lluís
out url icon Recercat Photophysics of fulvene under the non-resonant stark effect: shaping the conical intersection seam Ruiz-Barragán, Sergi ; Blancafort San José, Lluís
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