Книги з теми "Gas-Phase Ion/Ion Reactions"

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1

NATO Advanced Study Institute on Fundamentals of Gas Phase Ion Chemistry (1990 Sainte-Odile, France). Fundamentals of gas phase ion chemistry. Dordrecht: Kluwer Academic Publishers in cooperation with NATO Scientific Affairs Division, 1991.

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2

Read, Paul A. Ion-molecule reactions and cluster ion formation of uranyl and related ions in the gas phase. [s.l.]: typescript, 1989.

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3

1932-, Jennings Keith R., North Atlantic Treaty Organization. Scientific Affairs Division., and NATO Advanced Study Institute on Fundamentals and Applications of Gas Phase Ion Chemistry (1995 : Grainau, Germany), eds. Fundamentals and applications of gas phase ion chemistry. Dordrecht: Kluwer Academic, 1999.

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4

Jennings, Keith R., ed. Fundamentals of Gas Phase Ion Chemistry. Dordrecht: Springer Netherlands, 1991. http://dx.doi.org/10.1007/978-94-011-3518-4.

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5

Simpson, Matthew J. Two Studies in Gas-Phase Ion Spectroscopy. Berlin, Heidelberg: Springer Berlin Heidelberg, 2012. http://dx.doi.org/10.1007/978-3-642-23129-2.

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6

Jennings, Keith R., ed. Fundamentals and Applications of Gas Phase Ion Chemistry. Dordrecht: Springer Netherlands, 1999. http://dx.doi.org/10.1007/978-94-011-4754-5.

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7

Adams, N. G. Advances in Gas Phase Ion Chemistry, Volume 4. Burlington: Elsevier, 2001.

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8

Falcini, Mark R. A. A study of gas phase ion chemistry using high pressure mass spectrometry. [s.l.]: typescript, 1992.

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9

1930-, Russell David H., ed. Gas phase inorganic chemistry. New York: Plenum Press, 1989.

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10

Rutherford, Aris, ed. Surveying a dynamical system: A study of the Gray-Scott reaction in a two-phase reactor. Harlow: Longman, 1995.

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11

Bowers, Michael T. Gas Phase Ion Chemistry: Volume 1. Elsevier Science & Technology Books, 2016.

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12

Bowers, Michael T. Gas Phase Ion Chemistry: Volume 2. Elsevier Science & Technology Books, 2017.

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13

Adams, N. G., and L. M. Babcock. Advances in Gas Phase Ion Chemistry, Volume 4 (Advances in Gas Phase Ion Chemistry). Elsevier Science, 2001.

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14

Gas phase ion-molecule reaction rate constants through 1986. Tokyo, Japan: Ion Reaction Research Group of the Mass Spectroscopy Society of Japan, 1987.

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15

Gas phase ion-molecule reaction rate constants through 1986. Tokyo, Japan: Ion Reaction Research Group of the Mass Spectroscopy Society of Japan, 1987.

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16

Simpson, Matthew J. J. Two Studies in Gas-Phase Ion Spectroscopy: Vacuum-Ultraviolet Negative Photoion Spectroscopy and Ion-Molecule Reaction Kinetics. Springer, 2013.

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17

Simpson, Matthew J. Two Studies in Gas-Phase Ion Spectroscopy: Vacuum-Ultraviolet Negative Photoion Spectroscopy and Ion-Molecule Reaction Kinetics. Springer, 2011.

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18

Carr, Scott R. Gas-phase reactions of amino acids and small peptides as studied in a Fourier transform ion cyclotron resonance mass spectrometer. 1997.

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19

Westenberg, A. A., R. B. Cundall, J. R. Jones, and K. R. Jennings. Ion Association in Proton Transfer Reactions: Use of ESR for the Quantitative Determination of Gas Phase Atom and Radical Concentrations. Elsevier Science & Technology Books, 2013.

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20

Carr, Scott R. Gas-phase reactions of amino acids and small peptides as studied in a Fourier transform ion cyclotron resonance mass spectrometer. 1997.

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21

(Editor), S. S. Wu, ed. Nuclear Phase Transitions and Heavy Ion Reactions: Proceedings of an International Summer School Jilin University, Changchun, China--June, 1986. World Scientific Pub Co Inc, 1987.

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22

Pallante, Giovanni Antonio. Gas-phase reactions and modeling of [M+2H]p2+s for bradykinin and several of its fragments as studied by Fourier transform ion cyclotron resonance mass spectrometry. 1999.

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23

Pallante, Giovanni Antonio. Gas-phase reactions and modeling of [M+2H]p2+s for bradykinin and several of its fragments as studied by Fourier transform ion cyclotron resonance mass spectrometry. 1999.

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24

Adams, Nigel G. Advances in Gas Phase Ion Chemistry: 1992 (Advances in Gas Phase Ion Chemistry). Jai Pr, 1992.

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25

Adams, N. G., and L. M. Babcock. Advances in Gas Phase Ion Chemistry, Volume 3 (Advances in Gas Phase Ion Chemistry). JAI Press, 1998.

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26

Adams, Nigel G. Advances in Gas Phase Ion Chemistry, Volume 2 (Advances in Gas Phase Ion Chemistry). JAI Press, 1996.

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27

Advances in gas phase ion chemistry. Greenwich, Conn: Jai Press, 1996.

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28

Graham, Adams Nigel, and Babcock Lucia M, eds. Advances in gas-phase ion chemistry. Greenwich, Conn: Jai Press, 1998.

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29

Graham, Adams Nigel, and Babcock Lucia M, eds. Advances in gas phase ion chemistry. Greenwich, Conn: JAI Press, 1992.

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30

(Editor), Nigel G. Adams, and Lucia M. Babcock (Editor), eds. Advances in Gas Phase Ion Chemistry. Jai Pr, 1999.

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31

1935-, Lias Sharon G., and United States. National Bureau of Standards., eds. Gas-phase ion and neutral thermochemistry. New York: Published by the American Chemical Society and the American Institute of Physics for the National Bureau of Standards, 1988.

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32

Adams, N. G., and L. M. Babcock. Advances in Gas Phase Ion Chemistry. Elsevier Science & Technology Books, 1998.

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33

Adams, Nigel G., and Lucia M. Babcock. Advances in Gas Phase Ion Chemistry. Elsevier Science & Technology Books, 1996.

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34

Advances in gas phase ion chemistry. Amsterdam: JAI, 2001.

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35

Jennings, K. R. Fundamentals of Gas Phase Ion Chemistry. Springer, 2012.

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36

Jennings, K. R. Fundamentals of Gas Phase Ion Chemistry. Ingramcontent, 2012.

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37

Viehland, Larry A. Gaseous Ion Mobility, Diffusion, and Reaction. Springer, 2019.

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38

Jennings, K. R. Fundamentals and Applications of Gas Phase Ion Chemistry. Springer, 1998.

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39

Jennings, K. R. Fundamentals and Applications of Gas Phase Ion Chemistry. Springer, 2012.

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40

Advances in gas phase ion chemistry. Vol. 1 (1992)-. Greenwich, CT: JAI Press, 1992.

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41

Russell, David Harris. Gas Phase Inorganic Chemistry. Springer London, Limited, 2012.

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42

Henriksen, Niels Engholm, and Flemming Yssing Hansen. Introduction to Condensed-Phase Dynamics. Oxford University Press, 2018. http://dx.doi.org/10.1093/oso/9780198805014.003.0009.

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Анотація:
This chapter discusses chemical reactions in solution; first, how solvents modify the potential energy surface of the reacting molecules and second, the role of diffusion. As a first approximation, solvent effects are described by models where the solvent is represented by a dielectric continuum, focusing on the Onsager reaction-field model for solvation of polar molecules. The reactants of bimolecular reactions are brought into contact by diffusion, and the interplay between diffusion and chemical reaction that determines the overall reaction rate is described. The solution to Fick’s second law of diffusion, including a term describing bimolecular reaction, is discussed. The limits of diffusion control and activation control, respectively, are identified. It concludes with a stochastic description of diffusion and chemical reaction based on the Fokker–Planck equation, which includes the diffusion of particles interacting via a potential U(r).
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43

E, Spear W., and Commission of the European Communities. Directorate-General for Science, Research and Development., eds. Amorphous silicon photovoltaic junctions produced by gas-phase doping and by ion implantation. Luxembourg: Commission of the European Communities, 1985.

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44

Sherwood, Dennis, and Paul Dalby. Reactions in solution. Oxford University Press, 2018. http://dx.doi.org/10.1093/oso/9780198782957.003.0016.

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Анотація:
Another key chapter, examining reactions in solution. Starting with the definition of an ideal solution, and then introducing Raoult’s law and Henry’s law, this chapter then draws on the results of Chapter 14 (gas phase equilibria) to derive the corresponding results for equilibria in an ideal solution. A unique feature of this chapter is the analysis of coupled reactions, once again using first principles to show how the coupling of an endergonic reaction to a suitable exergonic reaction results in an equilibrium mixture in which the products of the endergonic reaction are present in much higher quantity. This demonstrates how coupled reactions can cause entropy-reducing events to take place without breaking the Second Law, so setting the scene for the future chapters on applications of thermodynamics to the life sciences, especially chapter 24 on bioenergetics.
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45

Lias, Sharon G. Gas Phase Ion and Neutral Thermochemistry (Journal of Physical and Chemical Reference Data, Vol 17, Supplement, No 1). AIP Press, 1988.

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46

Ewing, Nigel Phillip. Conformational and structural elucidation of negative and positive ions in the gas phase employing Fourier tranform ion cyclotron resonance mass spectometry. 1999.

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47

Henriksen, Niels E., and Flemming Y. Hansen. Theories of Molecular Reaction Dynamics. Oxford University Press, 2018. http://dx.doi.org/10.1093/oso/9780198805014.001.0001.

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Анотація:
This book deals with a central topic at the interface of chemistry and physics—the understanding of how the transformation of matter takes place at the atomic level. Building on the laws of physics, the book focuses on the theoretical framework for predicting the outcome of chemical reactions. The style is highly systematic with attention to basic concepts and clarity of presentation. Molecular reaction dynamics is about the detailed atomic-level description of chemical reactions. Based on quantum mechanics and statistical mechanics or, as an approximation, classical mechanics, the dynamics of uni- and bimolecular elementary reactions are described. The first part of the book is on gas-phase dynamics and it features a detailed presentation of reaction cross-sections and their relation to a quasi-classical as well as a quantum mechanical description of the reaction dynamics on a potential energy surface. Direct approaches to the calculation of the rate constant that bypasses the detailed state-to-state reaction cross-sections are presented, including transition-state theory, which plays an important role in practice. The second part gives a comprehensive discussion of basic theories of reaction dynamics in condensed phases, including Kramers and Grote–Hynes theory for dynamical solvent effects. Examples and end-of-chapter problems are included in order to illustrate the theory and its connection to chemical problems. The book has ten appendices with useful details, for example, on adiabatic and non-adiabatic electron-nuclear dynamics, statistical mechanics including the Boltzmann distribution, quantum mechanics, stochastic dynamics and various coordinate transformations including normal-mode and Jacobi coordinates.
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48

Henriksen, Niels Engholm, and Flemming Yssing Hansen. Static Solvent Effects, Transition-State Theory. Oxford University Press, 2018. http://dx.doi.org/10.1093/oso/9780198805014.003.0010.

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Анотація:
This chapter discusses static solvent effects on the rate constant for chemical reactions in solution. It starts with a brief discussion of the thermodynamic formulation of transition-state theory. The static equilibrium structure of the solvent will modify the potential energy surface for the chemical reaction. This effect is analyzed within the framework of transition-state theory. The rate constant is expressed in terms of the potential of mean force at the activated complex. Various definitions of this potential and their relations to n-particle- and pair-distribution functions are considered. The potential of mean force may, for example, be defined such that the gradient of the potential gives the average force on an atom in the activated complex, Boltzmann averaged over all configurations of the solvent. It concludes with a discussion of a relation between the rate constants in the gas phase and in solution.
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49

1946-, Thurman E. M., and Geological Survey (U.S.), eds. Method of analysis by the U.S. Geological Survey Organic Geochemistry Research Group: Determination of triazine and chloroacetanilide herbicides in water by solid-phase extraction and capillary-column gas chromatography/mass spectrometry with selected-ion monitoring. Lawrence, Kan: U.S. Dept. of the Interior, U.S. Geological Survey, 1999.

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50

Fox, Raymond. The Use of Self. Oxford University Press, 2011. http://dx.doi.org/10.1093/oso/9780190616144.001.0001.

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Анотація:
This monograph presents recent advances in neural network (NN) approaches and applications to chemical reaction dynamics. Topics covered include: (i) the development of ab initio potential-energy surfaces (PES) for complex multichannel systems using modified novelty sampling and feedforward NNs; (ii) methods for sampling the configuration space of critical importance, such as trajectory and novelty sampling methods and gradient fitting methods; (iii) parametrization of interatomic potential functions using a genetic algorithm accelerated with a NN; (iv) parametrization of analytic interatomic potential functions using NNs; (v) self-starting methods for obtaining analytic PES from ab inito electronic structure calculations using direct dynamics; (vi) development of a novel method, namely, combined function derivative approximation (CFDA) for simultaneous fitting of a PES and its corresponding force fields using feedforward neural networks; (vii) development of generalized PES using many-body expansions, NNs, and moiety energy approximations; (viii) NN methods for data analysis, reaction probabilities, and statistical error reduction in chemical reaction dynamics; (ix) accurate prediction of higher-level electronic structure energies (e.g. MP4 or higher) for large databases using NNs, lower-level (Hartree-Fock) energies, and small subsets of the higher-energy database; and finally (x) illustrative examples of NN applications to chemical reaction dynamics of increasing complexity starting from simple near equilibrium structures (vibrational state studies) to more complex non-adiabatic reactions. The monograph is prepared by an interdisciplinary group of researchers working as a team for nearly two decades at Oklahoma State University, Stillwater, OK with expertise in gas phase reaction dynamics; neural networks; various aspects of MD and Monte Carlo (MC) simulations of nanometric cutting, tribology, and material properties at nanoscale; scaling laws from atomistic to continuum; and neural networks applications to chemical reaction dynamics. It is anticipated that this emerging field of NN in chemical reaction dynamics will play an increasingly important role in MD, MC, and quantum mechanical studies in the years to come.
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