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µØÖ·£º http://comp.chem.umn.edu/Truhlar/bookchap.htm ÏÞÓÚ×ÖÊý£¬Ö»ÂÞÁм¸±¾£º 70. "Multilevel Methods for Thermochemistry and Thermochemical Kinetics," B. J. Lynch and D. G. Truhlar, in Recent Advances in Electron Correlation methodology, edited by A. K. Wilson (Oxford University Press, American Chemical Society Symposium Series Volume 958, Washington, DC, 2007), pp. 153-167. Available as PDF file 71. "Variational Transition State Theory and Multidimensional Tunneling for Simple and Complex Reactions in the Gas Phase, Solids, Liquids, and Enzymes," D. G. Truhlar, in Isotope Effects in Chemistry and Biology, edited by A. Kohen and H.-H. Limbach (Marcel Dekker, Inc., New York, 2006), pp. 579-620. Available as PDF file 72. "Hydrogen Atom Transfers in B12 Enzymes," R. Banerjee, D. G. Truhlar, A. Dybala-Defratyka, P. Paneth, in Hydrogen Transfer Reactions, edited by J. T. Hynes, J. P. Klinman, H.-H. Limbach, and R. L. Schowen (Wiley-VCH, Weinheim, Germany, 2007), Vol. 4, pp. 1473-1495. Available as PDF file 73. "Variational Transition State Theory in the Treatment of Hydrogen Transfer Reactions, " D. G. Truhlar and B. C. Garrett, in Hydrogen Transfer Reactions, edited by J. T. Hynes, J. P. Klinman, H. H. Limbach, and R. L. Schowen (Wiley-VCH, Weinheim, Germany, 2007), Vol. 2, pp. 833-874. Available as PDF file 74. "Decoherence in Combined Quantum Mechanical and Classical Mechanical Methods for Dynamics as Illustrated for Non-Born-Oppenheimer Trajectories," D. G. Truhlar, in Quantum Dynamics of Complex Molecular Systems, edited by D. A. Micha and I. Burghardt. Springer Series in Chemical Physics, Vol. 83 (Springer, Berlin, 2007), pp. 227-243. Available as PDF file 75. "Variational Transition State Theory," B. C. Garrett and D. G. Truhlar, in Theory and Applications of Computational Chemistry: The First Forty Years, edited by C. E. Dykstra, Gernot Frenking, Kwang Kim, Gustavo Scuseria (Elsevier, Amsterdam, 2005), pp. 67-87. CODEN: 69HSJX Available as PDF file 76. "Variational Transition State Theory with Multidimensional Tunneling," A. Fernandez-Ramos, B. A. Ellingson, B. C. Garrett, and D. G. Truhlar, in Reviews in Computational Chemistry, Vol. 23, edited by K. B. Lipkowitz and T. R. Cundari (Wiley-VCH, Hoboken, NJ, 2007), pp. 125-232. Available as PDF file 77. ¡°SMx Continuum Models for Condensed Phases,¡± C. J. Cramer and D. G. Truhlar, in Trends and Perspectives in Modern Computational Science, Lecture Series on Computer and Computational Sciences, Vol. 6, edited by G. Maroulis and T.E. Simos (Brill/VSP, Leiden, 2006), pp. 112-140. Available as PDF file 78. "Transition State Theory and Chemical Reaction Dynamics in Solution," D. G. Truhlar and J. R. Pliego Jr., in Continuum Solvation Models in Chemical Physics: From Theory to Applications, edited by B. Mennucci and R. Cammi (Wiley, Chichester, 2007), pp. 338-365. Available as PDF file 79. "Al Nanoparticles: Accurate Potential Energy Functions and Physical Properties," N. E. Schultz, A. W. Jasper, D. Bhatt, J. I. Siepmann, and D. G. Truhlar, in Multiscale Simulation Methods for Nanomaterials, edited by R. B. Ross and S. Mohanty (Wiley, Hoboken, 2008), pp. 169-188. Available as PDF file 80. "Quantum Catalysis in Enzymes,," Dybala-Defratyka, P. Paneth, D.G. Truhlar, in Quantum Tunneling in Enzyme Catalyzed Reactions, edited by R. K. Allemann and N. S. Scrutton (Royal Society of Chemistry, Cambridge, UK, 2009), pp. 36-78. Available as PDF file |
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