| ![](/p.gif) |
![](/p.gif) |
| Artikel-Nr.: 5667A-9783642249679 Herst.-Nr.: 9783642249679 EAN/GTIN: 9783642249679 |
| |
|
| ![](/p.gif) | ![](/p.gif) |
![](/p.gif) | First-Principles-Based Multiscale, Multiparadigm Molecular Mechanics and Dynamics Methods for Describing Complex Chemical Processes, by A. Jaramillo-Botero, R. Nielsen, R. Abrol, J. Su, T. Pascal, J. Mueller and W. A. Goddard.- Dynamic QM/MM: A Hybrid Approach to Simulating Gas-Liquid Interactions, by S. Yockel and G. C. Schatz.- Multiscale Modelling in Computational Heterogeneous Catalysis, by F. J. Keil.- Real-World Predictions from Ab Initio Molecular Dynamics Simulations, by B. Kirchner, P. J. di Dio and J. Hutter.- Nanoscale Wetting Under Electric Field from Molecular Simulations, by C. D. Daub, D. Bratko and A. Luzar.- Molecular Simulations of Retention in Chromatographic Systems: Use of Biased Monte Carlo Techniques to Access Multiple Time and Length Scales, by J. L. Rafferty, J. I. Siepmann, M. R. Schure.- Thermodynamic Properties for Applications in Chemical Industry via Classical Force Fields, by G. Guevara-Carrion, H. Hasse and J. Vrabec.- Multiscale Approaches and Perspectives to Modeling Aqueous Electrolytes and Polyelectrolytes, by L. Delle Site, C. Holm and N. F. A. van der Vegt.- Coarse-Grained Modeling for Macromolecular Chemistry, by H. A. Karimi-Varzaneh and F. Müller-Plathe.- Weitere Informationen: ![](/p.gif) | ![](/p.gif) | Author: | Barbara Kirchner; Jadran Vrabec | Verlag: | Springer Berlin | Sprache: | eng |
|
| ![](/p.gif) | ![](/p.gif) |
![](/p.gif) | | ![](/p.gif) | ![](/p.gif) |
![](/p.gif) | Weitere Suchbegriffe: Datenverarbeitung / Anwendungen / Wissenschaften, Mathematik / Physik, Chemie, Course-grained modelling, Gas -liquid interaction simulation, Hierarchically structured materials, Mesoporous materials, Modeling aqueous electrolytes, Modeling aqueous polyelectrolytes, Multiscale molecular methods, Nanoscale wetting, Post-Hartree-Fock methods |
| ![](/p.gif) | ![](/p.gif) |
| |