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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| Format: | Électronique Chapitre de livre |
| Langue: | anglais |
| Publié: |
Florence
Firenze University Press
2014
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| Collection: | Premio Tesi di Dottorato
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| Sujets: | |
| Accès en ligne: | DOAB: download the publication DOAB: description of the publication |
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