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11	Ab initio molecular dynamics study of the solvation effect on chlorine hydrolysis and its reverse reaction. January 1999 (has links) Siu Chi-kit. / Thesis (M.Phil.)--Chinese University of Hong Kong, 1999. / Includes bibliographical references (leaves 48-52). / Abstracts in English and Chinese. / TITLE PAGE --- p.i / THESIS COMMITTEE --- p.ii / ABSTRACT (ENGLISH) --- p.iii / (CHINESE) --- p.iv / ACKNOWLEDGEMENTS --- p.v / TABLE OF CONTENTS --- p.vi / LIST OF TABLES --- p.viii / LIST OF FIGURES --- p.ix / Chapter CHAPTER 1 --- Introduction --- p.1 / Chapter Section 1.1 --- Introduction --- p.1 / Chapter Section 1.2 --- Reaction of Chlorine Hydrolysis and Its Reverse Reaction --- p.2 / Chapter 1.2.1 --- Reaction in the Gas Phase --- p.2 / Chapter 1.2.2 --- Reaction in Aqueous Solution --- p.4 / Chapter 1.2.3 --- Reaction on Ice Surface --- p.5 / Chapter Section 1.3 --- Computational Method --- p.6 / Chapter Section 1.4 --- Study of Chemical Reaction by Constraint Molecular Dynamics --- p.8 / Chapter 1.4.1 --- Constraint Molecular Dynamics --- p.8 / Chapter 1.4.2 --- RATTLE Constraint Dynamics --- p.9 / Chapter 1.4.3 --- Free Energy of Chemical Reaction --- p.10 / Chapter 1.4.4 --- Radial Distribution Function --- p.11 / Chapter CHAPTER 2 --- "Ab initio Molecular Dynamics Study of the Reaction Between HC1 and HOC1 in Gas Phase, in Aqueous Solution and on Ice Surface" --- p.12 / Chapter Section 2.1 --- Structure of the Isolated Molecules --- p.13 / Chapter Section 2.2 --- Chlorine Hydrolysis in Aqueous Solution --- p.17 / Chapter 2.2.1 --- Model --- p.17 / Chapter 2.2.2 --- Results and Discussion --- p.18 / Chapter 2.2.3 --- Conclusion --- p.31 / Chapter Section 2.3 --- Heterogeneous Reaction of HC1 and HOC1 on Ice Surface --- p.32 / Chapter 2.3.1 --- Model --- p.32 / Chapter 2.3.2 --- Results and Discussion --- p.36 / Chapter 2.3.3 --- Conclusion --- p.45 / Chapter Section 2.4 --- "Comparison of the Reaction between HC1 and HOC1 in Gas Phase, in Aqueous Solution and on Ice Surface" --- p.46 / REFERENCES --- p.48 Molecular dynamics Solvation Chlorine Hydrolysis
12	Keq and [delta] H for the esterification of glycine in alcohol-water systems Artz, Susan Carol January 2011 (has links) Photocopy of typescript. / Digitized by Kansas Correctional Industries Esterification--Thermodynamics Chemical equilibrium Enthalpimetric titration
13	Studies on the conformational behaviour of x, w-amino acids in aqueous solution. Job, John Leonard January 1973 (has links) No description available. Amino acids Dipole moments
14	I Substituent effects on carbanion photophysics An application of the energy gap law : II Solvent and geometrical constraints on excited state proton transfer Nesselroth, Susan Marian 05 1900 (has links) No description available. Organic compounds Synthesis Protons
15	Integrating computational chemistry and mass spectrometry : a study of isomerization reactions of oxygen-containing ions in the gas phase / Fell, Lorne Montgomery. January 1999 (has links) Thesis (Ph.D.) -- McMaster University, 1999. / Includes bibliographical references. Also available via World Wide Web.
16	The combining weight of gelatin as an acid; The mobility of the gelatinate ion; The transference numbers and activities of sodium hydroxide in aqueous solution ... Schluchter, Alfred William, Ferguson, Alfred Lynn, January 1926 (has links) Thesis (PH. D.)--University of Michigan, 1926. / "By A.L. Ferguson and A.W. Schluchter." Also issued in print.
17	Diffusion potential studies: their application to the systems hydrochloric acid-sodium chloride, hydrochloric acid-gelatin and a new method for the determination of the equivalent weight of gelatin ... Bacon, Egbert King, Ferguson, Alfred Lynn, January 1927 (has links) Thesis (Ph. D.)--University of Michigan, 1926. / Reprinted from two articles by Alfred L. Ferguson and Egbert K. Bacon, published in the Journal of the American Chemical Society, v. 49, August, 1927.
18	The combining weight of gelatin as an acid; The mobility of the gelatinate ion; The transference numbers and activities of sodium hydroxide in aqueous solution ... Schluchter, Alfred William, Ferguson, Alfred Lynn, January 1926 (has links) Thesis (PH. D.)--University of Michigan, 1926. / "By A.L. Ferguson and A.W. Schluchter." eContent provider-neutral record in process. Description based on print version record.
19	Rapid reactions kinetics of the formation of the ferric thiocyanate complex / Below, John Frederick, January 1955 (has links) Thesis (Ph. D. in Chemistry)--University of California, Berkeley, Jan. 1956. / Includes bibliographical references (p. 115-116). 46
20	Diffusion potential studies: their application to the systems hydrochloric acid-sodium chloride, hydrochloric acid-gelatin and a new method for the determination of the equivalent weight of gelatin ... Bacon, Egbert King, Ferguson, Alfred Lynn, January 1927 (has links) Thesis (PH. D.)--University of Michigan, 1926. / Reprinted from two articles by Alfred L. Ferguson and Egbert K. Bacon, published in the Journal of the American Chemical Society, v. 49, August, 1927.

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