| 1 |
Wave packet methods for the direct calculation of energy-transfer moments in molecular collisions
Bradley KS, Schatz GC, Balint-Kurti GG
Journal of Physical Chemistry A, 103(7), 947, 1999 |
| 2 |
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 |
| 3 |
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 |
| 4 |
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 |
| 5 |
Direct Subsurface Absorption of Hydrogen on Pd(III)
Lovvik OM, Olsen RA
Journal of Chemical Physics, 104(11), 4330, 1996 |
| 6 |
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 |
| 7 |
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 |
| 8 |
Avoiding Long Propagation Times in Wave-Packet Calculations on Scattering with Resonances - A Hybrid Approach Involving the Lanczos Method
Kroes GJ, Neuhauser D
Journal of Chemical Physics, 105(20), 9104, 1996 |
| 9 |
Scattering of H-2 by LiF(001) Studied Using a New Model Potential .1. Prediction of Large Differences in Diffraction of Cold Beams of Para-H-2, and Normal-H-2
Kroes GJ, Mowrey RC
Journal of Chemical Physics, 103(6), 2186, 1995 |
| 10 |
H2O Photodissociation Dynamics Based on Potential-Energy Surfaces from Density-Functional Calculations
Doublet ML, Kroes GJ, Baerends EJ, Rosa A
Journal of Chemical Physics, 103(7), 2538, 1995 |
