| 1 |
Monte-Carlo Simulations of Surface-Reactions
Nieminen RM, Jansen AP
Applied Catalysis A: General, 160(1), 99, 1997 |
| 2 |
A Monte-Carlo Study of Co Oxidation with Oscillations Induced by Site Blocking
Jansen AP, Nieminen RM
Journal of Chemical Physics, 106(5), 2038, 1997 |
| 3 |
Convergence Study of Multi-Configuration Time-Dependent Hartree Simulations - H-2 Scattering from LiF(001)
Capellini A, Jansen AP
Journal of Chemical Physics, 104(9), 3366, 1996 |
| 4 |
Computation of the Infrared-Spectrum of an Acidic Zeolite Proton Interacting with Acetonitrile
Meijer EL, Vansanten RA, Jansen AP
Journal of Physical Chemistry, 100(22), 9282, 1996 |
| 5 |
Electronic-Structure Calculations and Dynamics of CC Coupling on Nickel and Cobalt
Burghgraef H, Jansen AP, Vansanten RA
Journal of Chemical Physics, 103(15), 6562, 1995 |
| 6 |
Ab-Initio Embedded-Cluster Study of the Adsorption of NH3 and Nh4+ in Chabazite
Teunissen EH, Jansen AP, Vansanten RA
Journal of Physical Chemistry, 99(7), 1873, 1995 |
| 7 |
A Multiconfiguration Time-Dependent Hartree Approximation Based on Natural Single-Particle States - Response
Jansen AP
Journal of Chemical Physics, 101(3), 2654, 1994 |
| 8 |
Adsorption Energies of NH3 and Nh4+ in Zeolites Corrected for the Long-Range Electrostatic Potential of the Crystal
Teunissen EH, Jansen AP, Vansanten RA, Orlando R, Dovesi R
Journal of Chemical Physics, 101(7), 5865, 1994 |
| 9 |
Electronic-Structure Calculations and Dynamics of Methane Activation on Nickel and Cobalt
Burghgraef H, Jansen AP, Vansanten RA
Journal of Chemical Physics, 101(12), 11012, 1994 |
| 10 |
Density-Functional Theory Calculations of the Transition-States for Hydrogen-Exchange and Dehydrogenation of Methane by a Bronsted Zeolitic Proton
Blaszkowski SR, Jansen AP, Nascimento MA, Vansanten RA
Journal of Physical Chemistry, 98(49), 12938, 1994 |
