[PDF.76ve] Multiscale Molecular Methods in Applied Chemistry (Topics in Current Chemistry)

Multiscale Molecular Methods in Applied Chemistry (Topics in Current Chemistry)

[PDF.wy36] Multiscale Molecular Methods in Applied Chemistry (Topics in Current Chemistry)

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 |  2013-11-29 |  2013-11-30 | Original language:English | PDF # 1 |  9.26 x.77 x6.11l,.0 | File type: PDF | 328 pages

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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 S...

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