2012

Johnston, Karen ; Herbers, Claudia R. ; Vegt, Nico F. A. van der (2012)
Development of Classical Molecule-Surface Interaction Potentials Based on Density Functional Theory Calculations: Investigation of Force Field Representability.
In: Journal of Physical Chemistry C, 116
Artikel, Bibliographie

Johnston, Karen ; Herbers, Claudia R. ; Vegt, Nico F. A. van der (2012)
Development of Classical Molecule–Surface Interaction Potentials Based on Density Functional Theory Calculations: Investigation of Force Field Representability.
In: The Journal of Physical Chemistry C, 116 (37)
doi: 10.1021/jp3044187
Artikel, Bibliographie

2011

Herbers, Claudia R. ; Johnston, Karen ; Vegt, Nico F. A. van der (2011)
Modelling molecule–surface interactions—an automated quantum-classical approach using a genetic algorithm.
In: Phys. Chem. Chem. Phys., 13
doi: 10.1039/c0cp02889d
Artikel, Bibliographie