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Introduction to Molecular Dynamics and Chemical Kinetics
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TLDR
In this paper, the classical model of Electron Transfer Reactions in Solution is used to model chemical reactions in solution, and a generalized transition state theory for unimolecular reactions is proposed.Abstract:
Interaction Potentials. Relative Motion. Collisional Approach. Partition Functions. Transition State Theory. Generalized Transition State Theory. Theory for Unimolecular Reactions. Classical Dynamics. Nonadiabatic Transitions. Surface Kinetics. Chemical Reactions in Solution. Energetic Aspects of Solvent Effects on Solutes. Models for Chemical Reactions in Solution. Kramers' Theory. The Classical Model of Electron Transfer Reactions in Solution. Appendices. Index.read more
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Plasma-liquid interactions: A review and roadmap
Peter Bruggeman,Mark J. Kushner,Bruce R. Locke,Jge Gardeniers,William Graham,David B. Graves,Rchm Hofman-Caris,D Marić,Jonathan P. Reid,E Ceriani,D. Fernandez Rivas,John E. Foster,Sean C. Garrick,Yury Gorbanev,Satoshi Hamaguchi,Felipe Iza,Helena Jablonowski,E. Klimova,Juergen F. Kolb,František Krčma,Petr Lukes,Zdenko Machala,Ilya Marinov,Davide Mariotti,S. Mededovic Thagard,Daisuke Minakata,Erik C. Neyts,Joanna Pawłat,Z. Lj. Petrović,R Pflieger,Stephan Reuter,DC Daan Schram,Sandra Schröter,Manabu Shiraiwa,Barbora Tarabová,Pa Tsai,Jrr Verlet,T. von Woedtke,Kevin R. Wilson,Kyuichi Yasui,G. Zvereva +40 more
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Experimental investigation on the formation of carbon-bearing molecules in the interstellar medium via neutral-neutral reactions.
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TheRate: Program for Ab Initio Direct Dynamics Calculations of Thermal and Vibrational-State-Selected Rate Constants
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Study of mixtures of n-dodecyl-β-d-maltoside with anionic, cationic, and nonionic surfactant in aqueous solutions using surface tension and fluorescence techniques
TL;DR: Fluorescence study not only supported the cmc results using tensiometry, but showed that interfaces of all the above mixed micelle/solution interfaces are mildly hydrophobic, implying that tested commercial alkyl polyglucosides are similar to the pure laboratory samples in synergistic interactions with other surfactants.
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Electron transfer kinetics in photosynthetic reaction centers embedded in trehalose glasses: trapping of conformational substates at room temperature.
TL;DR: It is concluded that, in solid trehalose-water glasses, the thermal fluctuations among conformational substates are inhibited, as inferred from the large broadening of the rate constant distribution for electron transfer obtained in solid glasses, which was due to the free energy distribution barriers having become quasi static.