Entropies of condensed phases and complex systems a first principles approach

Predicting thermodynamic quantities for chemically realistic systems on the basis of atomistic calculations is still, even today, a nontrivial task. Nonetheless, accurate treatment of inter-particle interactions, in terms of quantum chemical first principles methods, is a prerequisite for many appli...

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Bibliographic Details
Main Author: Spickermann, Christian
Corporate Author: SpringerLink (Online service)
Format: Electronic Resource
Language:English
Published: Berlin, Heidelberg, New York Springer c2011.
Subjects:
Online Access:Available for the University of the Philippines Diliman via SpringerLink. Click here to access