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Àngels González-Lafont

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2009
8EEJuan M. Ramírez-Anguita, Àngels González-Lafont, José M. Lluch: Formation pathways of DMSO from DMS-OH in the presence of O2 and NOx: A theoretical study. Journal of Computational Chemistry 30(2): 173-182 (2009)
7EEJuan M. Ramírez-Anguita, Àngels González-Lafont, José M. Lluch: Formation pathways of DMSO2 in the addition channel of the OH-initiated DMS oxidation: A theoretical study. Journal of Computational Chemistry 30(9): 1477-1489 (2009)
2007
6EEIsmael Tejero, Àngels González-Lafont, José M. Lluch: A PM3/d specific reaction parameterization for iron atom in the hydrogen abstraction catalyzed by soybean lipoxygenase-1. Journal of Computational Chemistry 28(6): 997-1005 (2007)
2005
5EENúria González-García, Àngels González-Lafont, José M. Lluch: Electronic structure study of the initiation routes of the dimethyl sulfide oxidation by OH. Journal of Computational Chemistry 26(6): 569-583 (2005)
2004
4EERicard Casadesús, Miquel Moreno, Àngels González-Lafont, José M. Lluch, Matthew P. Repasky: Testing electronic structure methods for describing intermolecular H · · · H interactions in supramolecular chemistry. Journal of Computational Chemistry 25(1): 99-105 (2004)
2003
3EELaura Masgrau, Àngels González-Lafont, José M. Lluch: Dependence of the rate constants on the treatment of internal rotation modes: The reaction OH + CH3SH CH3S + H2O as an example. Journal of Computational Chemistry 24(6): 701-706 (2003)
2000
2EEJordi Villá, Jörg Bentzien, Àngels González-Lafont, José M. Lluch, Juan Bertran, Arieh Warshel: Effective way of modeling chemical catalysis: Empirical valence bond picture of role of solvent and catalyst in alkylation reactions. Journal of Computational Chemistry 21(8): 607-625 (2000)
1999
1EELaura Masgrau, Àngels González-Lafont, José M. Lluch: Effect of a complex formation on the calculated low-pressure rate constant of a bimolecular gas-phase reaction governed by tunneling. Journal of Computational Chemistry 20(16): 1685-1692 (1999)

Coauthor Index

1Jörg Bentzien [2]
2Juan Bertran [2]
3Ricard Casadesús [4]
4Núria González-García [5]
5José M. Lluch [1] [2] [3] [4] [5] [6] [7] [8]
6Laura Masgrau [1] [3]
7Miquel Moreno [4]
8Juan M. Ramírez-Anguita [7] [8]
9Matthew P. Repasky [4]
10Ismael Tejero [6]
11Jordi Villá [2]
12Arieh Warshel [2]

Copyright © Sun May 17 03:24:02 2009 by Michael Ley (ley@uni-trier.de)