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S'han trobat 439 ítems

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Format	Data	Títol	Autor
Format	Data	Títol	Autor
		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
	9 maig 2019	Cerimònia d’investidura de doctor honoris causa a Sovan Lek i Evert Jan Baerends	Pineda, Jordi ; Solà i Puig, Miquel ; Swart, Marcel ; García-Berthou, Emili ; Salvi, Joaquim ; Lek, Sovan ; Baerends, Evert Jan
	10 octubre 2019	Cloenda de l’acte de graduació de la 12a promoció del Màster en Promoció de la Salut	Solà i Puig, Miquel
	8 juliol 2010	Closing	Solà i Puig, Miquel
	1996	A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods	Solà i Puig, Miquel ; Mestres i López, Jordi ; Carbó-Dorca, Ramon ; Duran i Portas, Miquel
		A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods	Solà i Puig, Miquel ; Mestres i López, Jordi ; Carbó-Dorca, Ramon ; Duran i Portas, Miquel
	15 febrer 2020	A comparative analysis by means of quantum molecular similarity measures of density distributions derived from conventional ab initio and density functional methods	Solà i Puig, Miquel ; Mestres i López, Jordi ; Carbó-Dorca, Ramon ; Duran i Portas, Miquel
		Comparison between alkalimetal and group 11 transition metal halide and hydride tetramers: Molecular structure and bonding	El Hamdi Lahfid, Majid ; Solà i Puig, Miquel ; Frenking, Gernot ; Poater i Teixidor, Jordi
	22 agost 2013	Comparison between alkalimetal and group 11 transition metal halide and hydride tetramers: Molecular structure and bonding	El Hamdi Lahfid, Majid ; Solà i Puig, Miquel ; Frenking, Gernot ; Poater i Teixidor, Jordi
		A complete guide on the influence of metal clusters in the diels-alder regioselectivity of Ih-C80 endohedral metallofullerenes	Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Luis Luis, Josep Maria ; Swart, Marcel ; Solà i Puig, Miquel
	25 octubre 2013	A complete guide on the influence of metal clusters in the diels-alder regioselectivity of Ih-C80 endohedral metallofullerenes	Garcia Borràs, Marc ; Osuna Oliveras, Sílvia ; Luis Luis, Josep Maria ; Swart, Marcel ; Solà i Puig, Miquel
		Complete σ* intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper (I) complex	Poater Teixidor, Albert ; Solà i Puig, Miquel
		Complete σ* intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper (I) complex	Poater Teixidor, Albert ; Solà i Puig, Miquel
	2013	Complete σ* intramolecular aromatic hydroxylation mechanism through O2 activation by a Schiff base macrocyclic dicopper (I) complex	Poater Teixidor, Albert ; Solà i Puig, Miquel
		Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting	El Hamdi Lahfid, Majid ; Solà i Puig, Miquel ; Poater i Teixidor, Jordi ; Timoshkin, A.
		Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting	El Hamdi Lahfid, Majid ; Solà i Puig, Miquel ; Poater i Teixidor, Jordi ; Timoshkin, A.
	5 juny 2018	Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting	El Hamdi Lahfid, Majid ; Solà i Puig, Miquel ; Poater i Teixidor, Jordi ; Timoshkin, A.
	5 juny 2016	Complexes of adamantine-based group 13 Lewis acids and superacids: bonding analysis and thermodynamics of hydrogen splitting	El Hamdi Lahfid, Majid ; Solà i Puig, Miquel ; Poater i Teixidor, Jordi ; Timoshkin, A.
	7 maig 2018	Computational chemistry applied to hydrocarbon functionalization by iron catalysts, oxidation state characterization, and electrides design	Postils Ribó, Verònica
		Computational Insight into the Mechanism of Alkane Hydroxylation by Non-heme Fe(PyTACN) Iron Complexes. Effects of the Substrate and Solvent	Postils, Verònica ; Company Casadevall, Anna ; Solà i Puig, Miquel ; Costas Salgueiro, Miquel ; Luis Luis, Josep Maria
		Computational Insight into the Mechanism of Alkane Hydroxylation by Non-heme Fe(PyTACN) Iron Complexes. Effects of the Substrate and Solvent	Postils, Verònica ; Company Casadevall, Anna ; Solà i Puig, Miquel ; Costas Salgueiro, Miquel ; Luis Luis, Josep Maria
	5 juny 2018	Computational Insight into the Mechanism of Alkane Hydroxylation by Non-heme Fe(PyTACN) Iron Complexes. Effects of the Substrate and Solvent	Postils, Verònica ; Company Casadevall, Anna ; Solà i Puig, Miquel ; Costas Salgueiro, Miquel ; Luis Luis, Josep Maria
	2015	Computational Insight into the Mechanism of Alkane Hydroxylation by Non-heme Fe(PyTACN) Iron Complexes. Effects of the Substrate and Solvent	Postils Ribó, Verònica ; Company Casadevall, Anna ; Solà i Puig, Miquel ; Costas Salgueiro, Miquel ; Luis Luis, Josep Maria
		Computational insight into Wilkinson’s complex catalyzed [2 + 2 + 2] cycloaddition mechanism leading to pyridine formation	Torres Antón, Òscar ; Roglans i Ribas, Anna ; Pla i Quintana, Anna ; Luis Luis, Josep Maria ; Solà i Puig, Miquel
	1 octubre 2014	Computational insight into Wilkinson’s complex catalyzed [2 + 2 + 2] cycloaddition mechanism leading to pyridine formation	Torres Antón, Òscar ; Roglans i Ribas, Anna ; Pla i Quintana, Anna ; Luis Luis, Josep Maria ; Solà i Puig, Miquel

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