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S'han trobat 173 ítems

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Format	Data	Títol	Autor
Format	Data	Títol	Autor
		Systematic study of the static electrical properties of the CO molecule: influence of the basis set size and correlation energy	Luis Luis, Josep Maria ; Martí, Josep ; Duran i Portas, Miquel ; Andrés, José Luís
		Theoretical Estimation of the Rate of Photoinduced Charge Transfer Reactions in Triphenylamine C60 Donor-Acceptor Conjugate	Martínez, Juan Pablo ; Solà i Puig, Miquel ; Voityuk, Alexander A.
		Theoretical Estimation of the Rate of Photoinduced Charge Transfer Reactions in Triphenylamine C60 Donor-Acceptor Conjugate	Martínez, Juan Pablo ; Solà i Puig, Miquel ; Voityuk, Alexander A.
	1 juny 2018	Theoretical Estimation of the Rate of Photoinduced Charge Transfer Reactions in Triphenylamine C60 Donor-Acceptor Conjugate
	5 juny 2018	Theoretical Estimation of the Rate of Photoinduced Charge Transfer Reactions in Triphenylamine C60 Donor-Acceptor Conjugate	Martínez López, Juan Pablo ; Solà i Puig, Miquel ; Voityuk, Alexander A.
	15 febrer 2020	Theoretical Estimation of the Rate of Photoinduced Charge Transfer Reactions in Triphenylamine C60 Donor-Acceptor Conjugate	Martínez López, Juan Pablo ; Solà i Puig, Miquel ; Voityuk, Alexander A.
	5 juny 2016	Theoretical Estimation of the Rate of Photoinduced Charge Transfer Reactions in Triphenylamine C60 Donor-Acceptor Conjugate	Martínez López, Juan Pablo ; Solà i Puig, Miquel ; Voityuk, Alexander A.
		Treatment of nonlinear optical properties due to large amplitude anharmonic vibrational motions: umbrella motion in NH3	Luis Luis, Josep Maria ; Reis, Heribert C. ; Papadopoulos, Manthos G. ; Kirtman, Bernard
	2006	Treatment of nonlinear optical properties due to large amplitude anharmonic vibrational motions: umbrella motion in NH3	Luis Luis, Josep Maria ; Reis, Heribert ; Papadopoulos, Manthos G. ; Kirtman, Bernard
	15 febrer 2020	Treatment of nonlinear optical properties due to large amplitude anharmonic vibrational motions: umbrella motion in NH3	Luis Luis, Josep Maria ; Reis, Heribert ; Papadopoulos, Manthos G. ; Kirtman, Bernard
		Triplet-triplet energy transfer in DNA: A process that occurs on the nanosecond timescale	Curutchet, Carles ; Voityuk, Alexander A.
		Triplet-triplet energy transfer in DNA: A process that occurs on the nanosecond timescale	Curutchet, Carles ; Voityuk, Alexander A.
		A valence bond description of the prefulvene extended conical intersection seam of benzene	Blancafort San José, Lluís ; Robb, Michael A.
	2012	A valence bond description of the prefulvene extended conical intersection seam of benzene	Blancafort San José, Lluís ; Robb, Michael A.
	juliol 2024	Validació de protocols de docking molecular per a l’enzim hidrolasa d’epòxid soluble	Marina Arboleas, Patricia
	2006	A variational approach for calculating Franck-Condon factors including mode-mode anharmonic coupling	Luis Luis, Josep Maria ; Kirtman, Bernard ; Christiansen, Ove
		A variational approach for calculating Franck-Condon factors including mode-mode anharmonic coupling	Luis Luis, Josep Maria ; Kirtman, Bernard ; Christiansen, Ove
	2007	Variational calculation of static and dynamic vibrational nonlinear optical properties	Luis Luis, Josep Maria ; Torrent Sucarrat, Miquel ; Christiansen, Ove ; Kirtman, Bernard
		Variational calculation of static and dynamic vibrational nonlinear optical properties	Luis Luis, Josep Maria ; Torrent Sucarrat, Miquel ; Christiansen, Ove ; Kirtman, Bernard
	2005	Variational calculation of vibrational linear and nonlinear optical properties	Torrent Sucarrat, Miquel ; Luis Luis, Josep Maria ; Kirtman, Bernard
		Variational calculation of vibrational linear and nonlinear optical properties	Torrent Sucarrat, Miquel ; Luis Luis, Josep Maria ; Kirtman, Bernard
		Wave Packet Dynamics at an Extended Seam of Conical Intersection: Mechanism of the Light-Induced Wolff Rearrangement	Li, Quansong ; Migani, Annapaola ; Blancafort San José, Lluís
	2012	Wave Packet Dynamics at an Extended Seam of Conical Intersection: Mechanism of the Light-Induced Wolff Rearrangement	Li, Quansong ; Migani, Annapaola ; Blancafort San José, Lluís

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