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Results: 1-19 |
Results: 19
Proton mobility in protonated glycylglycine and N-formylglycylglycinamide:a combined quantum chemical and RKKM study
Authors: Paizs, B Csonka, IP Lendvay, G Suhai, S
Citation: B. Paizs et al., Proton mobility in protonated glycylglycine and N-formylglycylglycinamide:a combined quantum chemical and RKKM study, RAP C MASS, 15(8), 2001, pp. 637-650
Proton mobility and main fragmentation pathways of protonated lysylglycine
Authors: Csonka, IP Paizs, B Lendvay, G Suhai, S
Citation: Ip. Csonka et al., Proton mobility and main fragmentation pathways of protonated lysylglycine, RAP C MASS, 15(16), 2001, pp. 1457-1472
Ab initio studies of complexes of HO2 radicals with NH3, H2O, and HF
Authors: Lendvay, G
Citation: G. Lendvay, Ab initio studies of complexes of HO2 radicals with NH3, H2O, and HF, Z PHYS CHEM, 215, 2001, pp. 377-392
A quasiclassical trajectory study of product energy and angular distributions for the OH+D-2 reaction
Authors: Lakin, MJ Troya, D Lendvay, G Gonzalez, M Schatz, GC
Citation: Mj. Lakin et al., A quasiclassical trajectory study of product energy and angular distributions for the OH+D-2 reaction, J CHEM PHYS, 115(11), 2001, pp. 5160-5169
The branching ratio between reaction and relaxation in the removal of H2O from its vertical bar 04 >(-) vibrational state in collisions with H atoms
Authors: Barnes, PW Sims, IR Smith, IWM Lendvay, G Schatz, GC
Citation: Pw. Barnes et al., The branching ratio between reaction and relaxation in the removal of H2O from its vertical bar 04 >(-) vibrational state in collisions with H atoms, J CHEM PHYS, 115(10), 2001, pp. 4586-4592
A quasiclassical trajectory study of angular and internal state distributions in H+H2O and H+D2O at E-T=1.4 eV
Authors: Troya, D Lendvay, G Gonzalez, M Schatz, GC
Citation: D. Troya et al., A quasiclassical trajectory study of angular and internal state distributions in H+H2O and H+D2O at E-T=1.4 eV, CHEM P LETT, 343(3-4), 2001, pp. 420-428
Formation of a(2)(+) ions of protonated peptides. An ab initio study
Authors: Paizs, B Szlavik, Z Lendvay, G Vekey, K Suhai, S
Citation: B. Paizs et al., Formation of a(2)(+) ions of protonated peptides. An ab initio study, RAP C MASS, 14(9), 2000, pp. 746-755
Proton mobility in protonated peptides: a joint molecular orbital and RRKMstudy
Authors: Csonka, IP Paizs, B Lendvay, G Suhai, S
Citation: Ip. Csonka et al., Proton mobility in protonated peptides: a joint molecular orbital and RRKMstudy, RAP C MASS, 14(6), 2000, pp. 417-431
On the correlation of bond order and bond length
Authors: Lendvay, G
Citation: G. Lendvay, On the correlation of bond order and bond length, J MOL ST-TH, 501, 2000, pp. 389-393
A new potential surface and quasiclassical trajectory study of H+H2O -> OH+H-2
Authors: Wu, G Schatz, GC Lendvay, G Fang, DC Harding, LB
Citation: G. Wu et al., A new potential surface and quasiclassical trajectory study of H+H2O -> OH+H-2, J CHEM PHYS, 113(8), 2000, pp. 3150-3161
A new potential surface and quasiclassical trajectory study of H+H2O -> OH+H-2 (vol 113, pg 3150, 2000)
Authors: Wu, GS Schatz, GC Lendvay, G Fang, DC Harding, LB
Citation: Gs. Wu et al., A new potential surface and quasiclassical trajectory study of H+H2O -> OH+H-2 (vol 113, pg 3150, 2000), J CHEM PHYS, 113(17), 2000, pp. 7712-7712
OH vibrational activation and decay dynamics of CH4-OH entrance channel complexes
Authors: Wheeler, MD Tsiouris, M Lester, MI Lendvay, G
Citation: Md. Wheeler et al., OH vibrational activation and decay dynamics of CH4-OH entrance channel complexes, J CHEM PHYS, 112(15), 2000, pp. 6590-6602
Reaction of H with highly vibrationally excited water: activated or not?
Authors: Schatz, GC Wu, G Lendvay, G Fang, DC Harding, LB
Citation: Gc. Schatz et al., Reaction of H with highly vibrationally excited water: activated or not?, FARADAY DIS, (113), 1999, pp. 151-165
Formation of b(2)(+) ions from protonated peptides: an ab initio study
Authors: Paizs, B Lendvay, G Vekey, K Suhai, S
Citation: B. Paizs et al., Formation of b(2)(+) ions from protonated peptides: an ab initio study, RAP C MASS, 13(6), 1999, pp. 525-533
Reactive and inelastic collisions of H atoms with vibrationally excited water molecules
Authors: Lendvay, G Bradley, KS Schatz, GC
Citation: G. Lendvay et al., Reactive and inelastic collisions of H atoms with vibrationally excited water molecules, J CHEM PHYS, 110(6), 1999, pp. 2963-2970
Exploring the reaction dynamics of nitrogen atoms: A combined crossed beamand theoretical study of N(D-2)+D-2 -> ND+D
Authors: Alagia, M Balucani, N Cartechini, L Casavecchia, P Volpi, GG Pederson, LA Schatz, GC Lendvay, G Harding, LB Hollebeek, T Ho, TS Rabitz, H
Citation: M. Alagia et al., Exploring the reaction dynamics of nitrogen atoms: A combined crossed beamand theoretical study of N(D-2)+D-2 -> ND+D, J CHEM PHYS, 110(18), 1999, pp. 8857-8860
General Discussion
Authors: Truhlar, DG Miller, WH Kuppermann, A Dellago, C Bowman, JM Basilevsky, MV Schulten, KJ Allen, WD Child, MS",Botschwina,"Chan, GKL Lendvay, G Morokuma, K Olivucci, M Martinez, TJ
Citation: Dg. Truhlar et al., General Discussion, FARADAY DIS, (110), 1998, pp. 91-104
Ab initio studies of the isomerization and decomposition reactions of the 1-butoxy radical
Authors: Lendvay, G Viskolcz, B
Citation: G. Lendvay et B. Viskolcz, Ab initio studies of the isomerization and decomposition reactions of the 1-butoxy radical, J PHYS CH A, 102(52), 1998, pp. 10777-10786
Some difficulties in computing BSSE-corrected potential surfaces of chemical reactions
Authors: Lendvay, G Mayer, I
Citation: G. Lendvay et I. Mayer, Some difficulties in computing BSSE-corrected potential surfaces of chemical reactions, CHEM P LETT, 297(5-6), 1998, pp. 365-373
Risultati: 1-19 |