The Potential Distribution Theorem and Models of Molecular Solutions

The Potential Distribution Theorem and Models of Molecular Solutions ( Cambridge University Press )

By Tom L. Beck, Michael E. Paulaitis, Lawrence R. Pratt,

Publisher: Cambridge University Press
Number Of Pages: 244
Publication Date: 2006-09-18
Sales Rank: 1687812
ISBN / ASIN: 0521822157
EAN: 9780521822152
Binding: Hardcover
Manufacturer: Cambridge University Press
Studio: Cambridge University Press

An understanding of statistical thermodynamic molecular theory is fundamental to the appreciation of molecular solutions. This complex subject has been simplified by the authors with down-to-earth presentations of molecular theory. Using the potential distribution theorem (PDT) as the basis, the text provides an up-to-date discussion of practical theories in conjunction with simulation results. The authors discuss the field in a concise and simple manner, illustrating the text with useful models of solution thermodynamics and numerous exercises. Modern quasi-chemical theories that permit statistical thermodynamic properties to be studied on the basis of electronic structure calculations are given extended development, as is the testing of those theoretical results with ab initio molecular dynamics simulations. The book is intended for students taking up research problems of molecular science in chemistry, chemical engineering, biochemistry, pharmaceutical chemistry, nanotechnology and biotechnology.

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