| 1 |
Chemically accurate simulation of dissociative chemisorption of D-2 on Pt (111)
Ghassemi EN, Wijzenbroek M, Somers MF, Kroes GJ
Chemical Physics Letters, 683, 329, 2017 |
| 2 |
Performance of a Non-Local van der Waals Density Functional on the Dissociation of H-2 on Metal Surfaces
Wijzenbroek M, Klein DM, Smits B, Somers MF, Kroes GJ
Journal of Physical Chemistry A, 119(50), 12146, 2015 |
| 3 |
The dependence of dissociative chemisorption of H-2 on Pd(111) on H-2 rotation: a six-dimensional quantum dynamics study
van Willigen RT, Somers MF, Busnengo HF, Kroes GJ
Chemical Physics Letters, 393(1-3), 166, 2004 |
| 4 |
Reactive scattering of H-2 from Cu(100): Six-dimensional quantum dynamics results for reaction and scattering obtained with a new, accurately fitted potential-energy surface
Somers MF, Olsen RA, Busnengo HF, Baerends EJ, Kroes GJ
Journal of Chemical Physics, 121(22), 11379, 2004 |
| 5 |
Diffractive and reactive scattering of (v=0, j=0) HD from Pt(111): Six-dimensional quantum dynamics compared with experiment
Kingma SM, Somers MF, Pijper E, Kroes GJ, Olsen RA, Baerends EJ
Journal of Chemical Physics, 118(9), 4190, 2003 |
| 6 |
Six-dimensional quantum and classical dynamics study of H-2(nu=0, J=0) scattering from Pd(111)
Busnengo HF, Pijper E, Somers MF, Kroes GJ, Salin A, Olsen RA, Lemoine D, Dong W
Chemical Physics Letters, 356(5-6), 515, 2002 |
| 7 |
Six-dimensional quantum dynamics of scattering of (v=0,j=0) H-2 and D-2 from Cu(111): test of two LEPS potential energy surfaces
Somers MF, Kingma SM, Pijper E, Kroes GJ, Lemoine D
Chemical Physics Letters, 360(3-4), 390, 2002 |
| 8 |
Constructing accurate potential energy surfaces for a diatomic molecule interacting with a solid surface: H-2+Pt(111) and H-2+Cu(100)
Olsen RA, Busnengo HF, Salin A, Somers MF, Kroes GJ, Baerends EJ
Journal of Chemical Physics, 116(9), 3841, 2002 |
| 9 |
Signatures of site-specific reaction of H-2 on Cu(100)
Somers MF, McCormack DA, Kroes GJ, Olsen RA, Baerends EJ, Mowrey RC
Journal of Chemical Physics, 117(14), 6673, 2002 |
| 10 |
Six-dimensional quantum dynamics of scattering of (v=0, j=0) H-2 from Pt(111): comparison to experiment and to classical dynamics results
Pjiper E, Somers MF, Kroes GJ, Olsen RA, Baerends EJ, Busnengo HF, Salin A, Lemoine D
Chemical Physics Letters, 347(4-6), 277, 2001 |
