
By Karl K.; and David J. Frurip (editors) Irikura
ISBN-10: 084121641X
ISBN-13: 9780841216419
ISBN-10: 0841235333
ISBN-13: 9780841235335
Read Online or Download Computational Thermochemistry. Prediction and Estimation of Molecular Thermodynamics PDF
Best physical chemistry books
Download PDF by F. Hirata: Molecular Theory of Solvation
Molecular idea of Solvation provides the hot development within the statistical mechanics of molecular beverages utilized to the main fascinating difficulties in chemistry this day, together with chemical reactions, conformational balance of biomolecules, ion hydration, and electrode-solution interface. The continuum version of "solvation" has performed a dominant position in describing chemical approaches in resolution over the past century.
Download e-book for iPad: Physical Chemistry of Macromolecules: Basic Principles and by S. F. Sun
Integrating insurance of polymers and organic macromolecules right into a unmarried textual content, actual Chemistry of Macromolecules is thoroughly dependent to supply a transparent and constant source for novices and pros alike. the fundamental wisdom of either biophysical and actual polymer chemistry is roofed, besides very important phrases, simple structural houses and relationships.
Advances in Chemical Physics Volume 140 - download pdf or read online
This sequence offers the chemical physics box with a discussion board for severe, authoritative reviews of advances in each region of the self-discipline.
Read e-book online Catalysis of Organic Reactions (Chemical Industries) PDF
This article bargains authoritative contributions from approximately two hundred leaders within the box and new easy methods to increase catalytic reactions. "Catalysis of natural Reactions" covers ways for designing, editing, and changing catalysts for more desirable functionality, functionality, and balance, tactics to minimize derivative formation, and low-cost choices for the hydrogenation of natural compounds.
- Chemical and biological kinetics; New horizons Vol 1
- Neutron Diffraction
- The foundations of physical organic chemistry : fifty years of the James Flack Norris Award
- Activation, Deactivation, and Poisoning of Catalysts
Extra info for Computational Thermochemistry. Prediction and Estimation of Molecular Thermodynamics
Sample text
Buss, J. H . J. Chem. Phys. 1958, 29, 546. For a recent résumé of the theory, see Cohen, N . ; Benson, S. W. ; Wiley: New York, N Y , 1992; pp 215-287. Ref. 1, p 26. Ref. 1, Appendix. Ref. 5. Cohen, N . J. Phys. Chem. Ref. Data 1996, 25, 1411. See, for example, Wu, Y . G . ; Patel, S. N . ; Ritter, E . ; Bozzelli, J. W. Thermochim. Acta 1993, 222, 153. Eigenmann, H . K . ; Golden, D. ; Benson, S. W. J. Phys. Chem. 1973, 77, 1687. Ducros, M . ; Gruson, J. F . ; H. Sannier, H . Thermochim. Acta, 1980, 36, 39.
Cis, ortho, and gauche effects, which involve atoms separated by at least two other atoms (normal group additivity rela tions take into account interactions between atoms with at most one atom between them). Some workers have tried to resolve these difficulties by introducing a nonadditive hindrance correction such as a buttress effect~an additional strain resulting from the presence o f three or more adjacent substituents (10). But the experi mental data at hand do not provide consistent justification for such an effect.
Chem. 1910, 116, 32. Reid, R. ; Prausnitz, J. ; Poling, B. E . ; McGraw-Hill: New York, N Y , 1987; Chap. 6. ; Gruson, J. F . ; Sannier, H . ; Velasco, I. Thermochim. Acta 1981, 44, 131. Ducros, M . ; Sannier, H . Thermochim. Acta 1982, 54, 153. Ducros, M . ; Sannier, H . Thermochim. Acta 1984, 75, 329. Benson, S. W . ; Golden, D. M . In Physical Chemistry; Eyring, H . ; Hender son, D . ; Jost, W . ; Academic Press: New York, N Y , 1975; Chap. 2. Benson, S. W . ; Seibert, E . D. J. Am. Chem. Soc.
Computational Thermochemistry. Prediction and Estimation of Molecular Thermodynamics by Karl K.; and David J. Frurip (editors) Irikura
by Kenneth
4.2