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From Quantum Mechanics to Force Fields
Tallenna

From Quantum Mechanics to Force Fields

The authors of this volume illustrate recent trends in the design and application of accurate force fields. Expert authors discuss the optimization and parametrization of new models, put in perspectives the actual importance of the polarization energy, as well as review or propose new models explicitly for incorporating polarization.
Alaotsikko
A Topical Collection from Theoretical Chemistry Accounts
ISBN
9783642344497
Kieli
englanti
Paino
446 grammaa
Julkaisupäivä
11.2.2013
Sivumäärä
204