|   | 2012 | Ab initio absorption spectrum of NiO combining molecular dynamics with the embedded cluster approach in a discrete reaction field | Domingo Toro, Alex
			
			;					Rodríguez Fortea, Antonio
			
			;					Swart, Marcel
			
			;					Graaf, Coen de
			
			;					Broer, Ria | 
	
	
		|   |  | Ab initio absorption spectrum of NiO combining molecular dynamics with the embedded cluster approach in a discrete reaction field | Domingo Toro, Alex
			
			;					Rodríguez Fortea, Antonio
			
			;					Swart, Marcel
			
			;					Graaf, Coen de
			
			;					Broer, Ria | 
	
	
		|   | 1998 | Additional compact formulas for vibrational dynamic dipole polarizabilities and hyperpolarizabilities | Bishop, David M.
			
			;					Luis Luis, Josep Maria
			
			;					Kirtman, Bernard | 
	
	
		|   |  | Additional compact formulas for vibrational dynamic dipole polarizabilities and hyperpolarizabilities | Bishop, David M.
			
			;					Luis Luis, Josep Maria
			
			;					Kirtman, Bernard | 
	
	
		|   | juliol 2024 | Anàlisi bioinformàtic de les interaccions i selectivitat d’inhibidors dels receptors Sigma 1 i Sigma 2 | Rispau Rustullet, Ferran | 
	
	
		|   | juny 2024 | Anàlisi bioinformàtic de la proteïna supressora de ferroptosi FSP1 i la seva interacció amb l’inhibidor icFSP1 | Fernández Bergés, Marc | 
	
	
		|   | 2000 | Anharmonicity contributions to the vibrational second hyperpolarizability of conjugated oligomers | Champagne, Benoît
			
			;					Luis Luis, Josep Maria
			
			;					Duran i Portas, Miquel
			
			;					Andrés, José Luís
			
			;					Kirtman, Bernard | 
	
	
		|   |  | Anharmonicity contributions to the vibrational second hyperpolarizability of conjugated oligomers | Champagne, Benoît
			
			;					Luis Luis, Josep Maria
			
			;					Duran i Portas, Miquel
			
			;					Andrés, José Luís
			
			;					Kirtman, Bernard | 
	
	
		|   | 2002 | Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? | Torrent Sucarrat, Miquel
			
			;					Luis Luis, Josep Maria
			
			;					Duran i Portas, Miquel
			
			;					Solà i Puig, Miquel | 
	
	
		|   |  | Are the maximum hardness and minimum polarizability principles always obeyed in nontotally symmetric vibrations? | Torrent Sucarrat, Miquel
			
			;					Luis Luis, Josep Maria
			
			;					Duran i Portas, Miquel
			
			;					Solà i Puig, Miquel | 
	
	
		|   |  | Basis set and electron correlation effects on initial convergence for vibrational nonlinear optical properties of conjugated organic molecules | Torrent Sucarrat, Miquel
			
			;					Solà i Puig, Miquel
			
			;					Duran i Portas, Miquel
			
			;					Luis Luis, Josep Maria
			
			;					Kirtman, Bernard | 
	
	
		|   | 15 febrer 2020 | Basis set and electron correlation effects on initial convergence for vibrational nonlinear optical properties of conjugated organic molecules | Torrent Sucarrat, Miquel
			
			;					Solà i Puig, Miquel
			
			;					Duran i Portas, Miquel
			
			;					Luis Luis, Josep Maria
			
			;					Kirtman, Bernard | 
	
	
		|   | 25 març 2004 | Basis set and electron correlation effects on initial convergence for vibrational nonlinear optical properties of conjugated organic molecules | Torrent Sucarrat, Miquel
			
			;					Solà i Puig, Miquel
			
			;					Duran i Portas, Miquel
			
			;					Luis Luis, Josep Maria
			
			;					Kirtman, Bernard | 
	
	
		|   | 1999 | Basis set superposition error-counterpoise corrected potential energy surfaces : application to hydrogen peroxide ... X (X=F-, Cl-, Br-, Li+, Na+) complexes | Daza, Martha C.
			
			;					Dobado, J. A.
			
			;					Molina Molina, José
			
			;					Salvador Sedano, Pedro
			
			;					Duran i Portas, Miquel
			
			;					Villaveces, José Luis | 
	
	
		|   |  | Basis set superposition error-counterpoise corrected potential energy surfaces : application to hydrogen peroxide ... X (X=F-, Cl-, Br-, Li+, Na+) complexes | Daza, Martha C.
			
			;					Dobado, J. A.
			
			;					Molina Molina, José
			
			;					Salvador Sedano, Pedro
			
			;					Duran i Portas, Miquel
			
			;					Villaveces, José Luis | 
	
	
		|   | 2005 | Calculation of Franck-Condon factors including anharmonicity: simulation of the C2 H4+ X̃2B 3u←C2 H4X̃1 Ag band in the photoelectron spectrum of ethylene | Luis Luis, Josep Maria
			
			;					Torrent Sucarrat, Miquel
			
			;					Solà i Puig, Miquel
			
			;					Bishop, David M.
			
			;					Kirtman, Bernard | 
	
	
		|   |  | Calculation of Franck-Condon factors including anharmonicity: simulation of the C2 H4+ X̃2B 3u←C2 H4X̃1 Ag band in the photoelectron spectrum of ethylene | Luis Luis, Josep Maria
			
			;					Torrent Sucarrat, Miquel
			
			;					Solà i Puig, Miquel
			
			;					Bishop, David M.
			
			;					Kirtman, Bernard | 
	
	
		|   | 2005 | Charge transfer in DNA: hole charge is confined to a single base pair due to solvation effects | Voityuk, Alexander A. | 
	
	
		|   |  | Charge transfer in DNA: hole charge is confined to a single base pair due to solvation effects | Voityuk, Alexander A. | 
	
	
		|   | 7 juliol 2023 | Computational exploration and design of HHDH variants with novel synthetically useful functionalities | Estévez-Gay, Miquel | 
	
	
		|   | 2 juny 2023 | Computational strategies for understanding the molecular basis of biochemical and biocatalytic processes | Calvó-Tusell, Carla | 
	
	
		|   |  | Computation of nonlinear optical properties of molecules with large amplitude anharmonic motions. III. Arbitrary double-well potentials | Reis, Heribert C.
			
			;					Luis Luis, Josep Maria
			
			;					Garcia Borràs, Marc
			
			;					Kirtman, Bernard | 
	
	
		|   | 14 gener 2014 | Computation of nonlinear optical properties of molecules with large amplitude anharmonic motions. III. Arbitrary double-well potentials | Reis, Heribert
			
			;					Luis Luis, Josep Maria
			
			;					Garcia Borràs, Marc
			
			;					Kirtman, Bernard | 
	
	
		|   | 2008 | Conformations of poly{G}-poly{C} π stacks with high hole mobility | Voityuk, Alexander A. | 
	
	
		|   |  | Conformations of poly{G}-poly{C} π stacks with high hole mobility | Voityuk, Alexander A. |