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Format	Data	Títol	Autor
Format	Data	Títol	Autor
		Communication: An approximation to Bader’s topological atom	Salvador Sedano, Pedro ; Ramos-Cordoba, Eloy
	1 juny 2018	Communication: An approximation to Bader’s topological atom
	5 juny 2018	Communication: An approximation to Bader’s topological atom	Salvador Sedano, Pedro ; Ramos-Cordoba, Eloy
	agost 2013	Communication: An approximation to Bader’s topological atom	Salvador Sedano, Pedro ; Ramos Cordoba, Eloy
	7 juliol 2023	Computational exploration and design of HHDH variants with novel synthetically useful functionalities	Estévez-Gay, Miquel
	26 setembre 2022	A computational micromechanics investigation of longitudinal strength in unidirectional fibre reinforced composites	Barzegar, Mostafa
	2 juny 2023	Computational strategies for understanding the molecular basis of biochemical and biocatalytic processes	Calvó-Tusell, Carla
	12 febrer 2021	Computational studies of the conformational landscape of allosteric and enantioselective enzymes	María Solano, Miguel Ángel
		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.
		A conical intersection model to explain aggregation induced emission in diphenyl dibenzofulvene	Li, Quansong ; Blancafort San José, Lluís
	2013	A conical intersection model to explain aggregation induced emission in diphenyl dibenzofulvene	Li, Quansong ; Blancafort San José, Lluís
		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
	14 abril 2015	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
	2012	Control and femtosecond time-resolved imaging of torsion in a chiral molecule	Hansen, Jonas L. ; Nielsen, Jens H. ; Madsen, Christian Bruun ; Lindhardt, Anders Thyboe ; Johansson, Mikael P. ; Skrydstrup, Troels ; Madsen, Lars Bojer ; Stapelfeldt, Henrik
		Control and femtosecond time-resolved imaging of torsion in a chiral molecule	Hansen, Jonas L. ; Nielsen, Jens H. ; Madsen, Christian Bruun ; Lindhardt, Anders Thyboe ; Johansson, Mikael P. ; Skrydstrup, Troels ; Madsen, Lars Bojer ; Stapelfeldt, Henrik
	1991	Corrientes baroclínicas y secas internas en el lago de Banyoles	Roget, Elena ; Casamitjana, Xavier ; Pararols, J.
	15 febrer 2020	Corrientes baroclínicas y secas internas en el lago de Banyoles	Roget, Elena ; Casamitjana, Xavier ; Pararols, J.
	2003	Counterpoise-corrected geometries and harmonic frequencies of N-body clusters: application to (HF)n (n=3,4)	Salvador Sedano, Pedro ; Szczȩśniak, Malgorzata M.
		Counterpoise-corrected geometries and harmonic frequencies of N-body clusters: application to (HF)n (n=3,4)	Salvador Sedano, Pedro ; Szczȩśniak, Malgorzata M.
		Critical analysis and extension of the Hirshfeld atoms in molecules	Bultinck, Patrick ; Van Alsenoy, Christian ; Ayers, Paul W. ; Carbó-Dorca, Ramon
	2007	Critical analysis and extension of the Hirshfeld atoms in molecules	Bultinck, Patrick ; Alsenoy, Christian van ; Ayers, Paul W. ; Carbó-Dorca, Ramon
	1 juny 2018	Critical analysis and extension of the Hirshfeld atoms in molecules

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