Modelling of spectroscopic and structural properties using molecular dynamics

The work described here was carried out at the European Lab. for Non-Linear Spectroscopy (LENS) to achieve a better understanding of molecular vibrations employing computer simulations. H-bonds are the main intermolecular interactions affecting vibrational spectra and here it's shown how they u...

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Bibliografski detalji
Glavni autor: MUNIZ-MIRANDA, Francesco (auth)
Format: Elektronički Poglavlje knjige
Jezik:engleski
Izdano: Florence Firenze University Press 2014
Serija:Premio Tesi di Dottorato 43
Teme:
Online pristup:OAPEN Library: download the publication
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