Authors: Jitariu, LC Wang, F Hillier, IH Pilling, MJ

Citation: Lc. Jitariu et al., Unimolecular decomposition of the n-C3H7 radical. Direct dynamics calculation of the thermal rate constant, PHYS CHEM P, 3(12), 2001, pp. 2459-2466

Authors: Jitariu, LC Hirst, DM

Citation: Lc. Jitariu et Dm. Hirst, Theoretical investigation of the N2O5 reversible arrow reversible arrow NO2+NO3 equilibrium by density functional theory and ab initio calculations, PCCP PHYS C, 2(4), 2000, pp. 847-852

Authors: Jenkins, HDB Jitariu, LC Krossing, I Passmore, J Suontamo, R

Citation: Hdb. Jenkins et al., Basis set and correlation effects in the calculation of accurate gas phasedimerization energies of two M-2(+) to give M-4(2+) (M = S, Se), J COMPUT CH, 21(3), 2000, pp. 218-226

Authors: Jitariu, LC Hirst, DM

Citation: Lc. Jitariu et Dm. Hirst, Theoretical investigation of the potential energy surface for the reactionof NO3 with H, PCCP PHYS C, 1(6), 1999, pp. 983-987

Authors: Jitariu, LC Hirst, DM

Citation: Lc. Jitariu et Dm. Hirst, Ab initio study of the reaction of NO3 with the OH radical, J PHYS CH A, 103(33), 1999, pp. 6673-6677