Authors:
Rozanska, X
Saintigny, X
van Santen, RA
Hutschka, F
Citation: X. Rozanska et al., A DFT study of isomerization and transalkylation reactions of aromatic species catalyzed by acidic zeolites, J CATALYSIS, 202(1), 2001, pp. 141-155
Citation: X. Rozanska et al., A DFT study of the cracking reaction of thiophene activated by small zeolitic clusters, J CATALYSIS, 200(1), 2001, pp. 79-90
Authors:
Rozanska, X
van Santen, RA
Hutschka, F
Hafner, J
Citation: X. Rozanska et al., A periodic DFT study of intramolecular isomerization reactions of toluene and xylenes catalyzed by acidic mordenite, J AM CHEM S, 123(31), 2001, pp. 7655-7667
Authors:
Vos, AM
Rozanska, X
Schoonheydt, RA
van Santen, RA
Hutschka, F
Hafner, J
Citation: Am. Vos et al., A theoretical study of the alkylation reaction of toluene with methanol catalyzed by acidic mordenite, J AM CHEM S, 123(12), 2001, pp. 2799-2809
Citation: X. Rozanska et C. Chipot, Modeling ion-ion interaction in proteins: A molecular dynamics free energycalculation of the guanidinium-acetate association, J CHEM PHYS, 112(22), 2000, pp. 9691-9694