Entropies of condensed phases and complex systems [electronic resource] : a first principles approach / Christian Spickermann.

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

Online Access:	Full Text (via Springer)
Main Author:	Spickermann, Christian
Format:	Thesis Electronic eBook
Language:	English
Published:	Berlin ; Heidelberg ; New York : Springer, ©2011.
Series:	Springer theses.
Subjects:	Entropy. Condensed matter. Complex compounds.