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140122 ||| eng |
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|a 9781461582700
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| 100 |
1 |
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|a Braunstein, J.
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| 245 |
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|a Advances in Molten Salt Chemistry
|h Elektronische Ressource
|b Volume 3
|c by J. Braunstein, Gleb Mamantov, G. P. Smith
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| 250 |
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|a 1st ed. 1975
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| 260 |
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|a New York, NY
|b Springer US
|c 1975, 1975
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| 300 |
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|a XII, 469 p. 29 illus
|b online resource
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| 505 |
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|a 1 Molecular Dynamics Calculations on Molten Ionic Salts -- 1. Introduction -- 2. Intermolecular Forces in Molten Salts -- 3. Computational Techniques -- 4. Calculation of Physical Properties -- 5. Applications -- 6. Conclusions -- 7. References -- 2 Gas Solubility in Molten Salts -- 1. Introduction -- 2. Experimental Techniques -- 3. Solution Thermodynamics -- 4. Calculation Methods -- 5. Appendix -- 6. References -- 3 Organic Reactions in Molten Tetrachloroaluminate Solvents -- 1. Introduction -- 2. Condensation-Addition Reactions -- 3. Dehydrogenation-Condensation Reactions -- 4. Molecular Rearrangements and Isomerizations -- 5. Miscellaneous Reactions -- 6. Organic Electrode Reactions -- 7. References -- 4 Experimental Techniques in Molten Fluoride Chemistry -- 1. Introduction -- 2. Thermochemistry of the Containment and Purification of Molten Fluorides -- 3. Handling Fluorides -- 4. Analysis -- 5. Design of Equipment -- 6. Absorption Spectroscopy of Molten Fluoride Solutions -- 7. Electrochemistry of Molten Fluoride Solutions -- 8. Miscellaneous Measurements -- 9. Presentation of Data of Equilibria in Molten Halides -- 10. Conclusions -- 11. References -- 5 The Chemistry of Thiocyanate Melts -- 1. Introduction -- 2. Chemistry of the Main Group Elements -- 3. Chemistry of the Transition Metals -- 4. Chemistry of the “F” Block Elements -- 5. Conclusion -- 6. References -- 6 Phase Diagrams of Binary and Ternary Fluoride Systems -- 1. Introduction -- 2. Binary Systems -- 3. Ternary Systems
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| 653 |
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|a Physical chemistry
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| 653 |
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|a Physical Chemistry
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| 700 |
1 |
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|a Mamantov, Gleb
|e [author]
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| 700 |
1 |
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|a Smith, G. P.
|e [author]
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| 041 |
0 |
7 |
|a eng
|2 ISO 639-2
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| 989 |
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|b SBA
|a Springer Book Archives -2004
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| 028 |
5 |
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|a 10.1007/978-1-4615-8270-0
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| 856 |
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|u https://doi.org/10.1007/978-1-4615-8270-0?nosfx=y
|x Verlag
|3 Volltext
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| 082 |
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|a 541
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| 520 |
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|a The first chapter of this volume deals with computer simulation of molten salt behavior by molecular dynamics calculations. The next four chapters are reviews of experimental work: Chapter 2 deals with the solubility of nonre active gases in molten salts, Chapter 3 with various types of organic reactions in molten tetrachloroaluminates, Chapter 4 with techniques for the study of molten fluorides, and Chapter 5 with the physical and chemical properties of thiocyanate melts. The last chapter is a collection of phase diagrams for binary and ternary fluoride systems. J. B., G. M., G. P. S. v CONTENTS Chapter 1 MOLECULAR DYNAMICS CALCULATIONS ON MOLTEN IONIC SALTS L. V. Woodcock 1. Introduction. . 4 2. Intermolecular Forces in Molten Salts 4 2.1. True and Effective Pair Potentials 2.2. Semiempirical Models 6 3. Computational Techniques 13 3.1. Molecular Dynamics Simulation 13 3.2. The Monte Carlo Method 15 3.3. Electrostatic Summations . . 18 4. Calculation of Physical Properties 23 4.1. Equilibrium Properties . 23 4.2. Transport Coefficients 27 4.3. Spectroscopic Properties 32 5. Applications. . . . . . . . 35 5.1. Studies of Interionic Forces. 35 5.2. Microstructure and Mechanisms 40 5.3. Interpretation of Experimental Observables 50 5.4. Reappraisal of Molten Salt Theories . 64 70 6. Conclusions 7. References. 72 vii Contents viii Chapter 2 GAS SOLUBILITY IN MOLTEN SALTS P. Field 1. Introduction 75 2. Experimental Techniques 78 3. Solution Thermodynamics
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