| 1 |
Dissociative adsorption of H-2 on Cu(100) : Fixed-site calculations for impact at hollow and top sites
Mowrey RC, Kroes GJ, Baerends EJ
Journal of Chemical Physics, 108(16), 6906, 1998 |
| 2 |
Avoiding Long Propagation Times in Wave-Packet Calculations on Scattering with Resonances - A New Algorithm Involving Filter Diagonalization
Kroes GJ, Wall MR, Pang JW, Neuhauser D
Journal of Chemical Physics, 106(5), 1800, 1997 |
| 3 |
Dissociative Adsorption of H-2 on Cu(100) - A 4-Dimensional Study of the Effect of Rotational Motion on the Reaction Dynamics
Mowrey RC, Kroes GJ, Wiesenekker G, Baerends EJ
Journal of Chemical Physics, 106(10), 4248, 1997 |
| 4 |
Reactant-Product Decoupling Approach to Half-Scattering Problems - Photodissociation of H2O in 3 Dimensions
Wang DY, Zhu W, Zhang JZ, Kouri DJ
Journal of Chemical Physics, 107(3), 751, 1997 |
| 5 |
Memory Kernels and Effective-Hamiltonians from Time-Dependent Methods .1. Predissociation with a Curve Crossing
Desouterlecomte M, Lievin J
Journal of Chemical Physics, 107(5), 1428, 1997 |
| 6 |
Direct Subsurface Absorption of Hydrogen on Pd(III)
Lovvik OM, Olsen RA
Journal of Chemical Physics, 104(11), 4330, 1996 |
| 7 |
Quantum-Mechanical 3-Dimensional Wavepacket Study of the Li+hf-)Lif+h Reaction
Gogtas F, Balintkurti GG, Offer AR
Journal of Chemical Physics, 104(20), 7927, 1996 |
| 8 |
Dissociative Chemisorption of H-2 on Cu(100) - A 4-Dimensional Study of the Effect of Parallel Translational Motion on the Reaction Dynamics
Kroes GJ, Wiesenekker G, Baerends EJ, Mowrey RC, Neuhauser D
Journal of Chemical Physics, 105(14), 5979, 1996 |
| 9 |
Time-Dependent Calculation of Reactive Flux Employing Complex Absorbing Potentials - General-Aspects and Application Within the Multiconfiguration Time-Dependent Hartree Wave Approach
Jackle A, Meyer HD
Journal of Chemical Physics, 105(16), 6778, 1996 |
| 10 |
Performance of a Time-Independent Scattering Wave-Packet Technique Using Real Operators and Wave-Functions
Kroes GJ, Neuhauser D
Journal of Chemical Physics, 105(19), 8690, 1996 |
