Publikationen von Nico F. A. van der Vegt
Alle Typen
Zeitschriftenartikel (57)
2013
Zeitschriftenartikel
110 (2), 026103 (2013)
Initial Electrospreading of Aqueous Electrolyte Drops. Physical Review Letters
Zeitschriftenartikel
117 (13), S. 6904 - 6913 (2013)
Understanding the Control of Mineralization by Polyelectrolyte Additives: Simulation of Preferential Binding to Calcite Surfaces. Journal of Physical Chemistry C 2012
Zeitschriftenartikel
8 (5), S. 1802 - 1807 (2012)
Kirkwood-Buff Coarse-Grained Force Fields for Aqueous Solutions. Journal of Chemical Theory and Computation
Zeitschriftenartikel
116 (37), S. 19781 - 19788 (2012)
Development of Classical Molecule-Surface Interaction Potentials Based on Density Functional Theory Calculations: Investigation of Force Field Representability. Journal of Physical Chemistry C
Zeitschriftenartikel
45 (5), S. 2551 - 2561 (2012)
A Chemically Accurate Implicit-Solvent Coarse-Grained Model for Polystyrenesulfonate Solutions. Macromolecules
Zeitschriftenartikel
8 (20), S. 5585 - 5594 (2012)
Hierarchical modelling of polystyrene surfaces. Soft Matter
Zeitschriftenartikel
8 (10), S. 3536 - 3541 (2012)
Preferential Solvation of Triglycine in Aqueous Urea: An Open Boundary Simulation Approach. Journal of Chemical Theory and Computation
Zeitschriftenartikel
8 (2), S. 375 - 379 (2012)
Kirkwood-Buff Analysis of Liquid Mixtures in an Open Boundary Simulation. Journal of Chemical Theory and Computation 2011
Zeitschriftenartikel
13 (22), S. 10412 - 10420 (2011)
Multiscale modeling of soft matter: scaling of dynamics. Physical Chemistry Chemical Physics
Zeitschriftenartikel
13 (22), S. 10577 - 10583 (2011)
Modelling molecule-surface interactions-an automated quantum-classical approach using a genetic algorithm. Physical Chemistry Chemical Physics
Zeitschriftenartikel
7 (6), S. 1916 - 1927 (2011)
Transferability of Coarse Grained Potentials: Implicit Solvent Models for Hydrated Ions. Journal of Chemical Theory and Computation 2010
Zeitschriftenartikel
43 (18), S. 7813 - 7827 (2010)
Carbon Dioxide Diffusion and Plasticization in Fluorinated Polyimides. Macromolecules
Zeitschriftenartikel
43 (5), S. 2605 - 2621 (2010)
Carbon Dioxide Solubility in Three Fluorinated Polyimides Studied by Molecular Dynamics Simulations. Macromolecules
Zeitschriftenartikel
6 (8), S. 2434 - 2444 (2010)
Transferability of Nonbonded Interaction Potentials for Coarse-Grained Simulations: Benzene in Water. Journal of Chemical Theory and Computation 2009
Zeitschriftenartikel
42 (19), S. 7579 - 7588 (2009)
Coarse-Grained Polymer Melts Based on Isolated Atomistic Chains: Simulation of Polystyrene of Different Tacticities. Macromolecules
Zeitschriftenartikel
5 (22), S. 4556 - 4563 (2009)
Hierarchical modeling of polymer permeation. Soft Matter
Zeitschriftenartikel
113 (3), S. 627 - 631 (2009)
Interaction of Water with N,N '-1,2-Ethanediyl-bis(6-hydroxy-hexanamide) Crystals: A Simulation Study. Journal of Physical Chemistry B
Zeitschriftenartikel
106 (32), S. 13296 - 13300 (2009)
Cation specific binding with protein surface charges. Proceedings of the National Academy of Sciences of the United States of America
Zeitschriftenartikel
42 (1), S. 384 - 391 (2009)
Structural Properties of Atactic Polystyrene of Different Thermal History Obtained from a Multiscale Simulation. Macromolecules
Zeitschriftenartikel
47 (12), S. 1166 - 1180 (2009)
Atomistic Models of Three Fluorinated Polyimides in the Amorphous State. Journal of Polymer Science Part B-Polymer Physics