Christian Spickermann: 1 book
Entropies of Condensed Phases and Complex Systems
A First Principles Approach
Language: English
Release Date: January 18, 2011
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 applications,...
