Vibrational analysis of glycine radical: a comparative ab initio static and dynamic study
Abstract
We present quantum mechanical (QM) vibrational computations beyond the harmonic approximation for an
* Corresponding authors
a
Groupe Chimie Théorique et Réactivité, ECP, IPREM UMR CNRS 5254, Université de Pau et des Pays de l’Adour 2, Rue Jules Ferry, Pau, France
E-mail:
philippe.carbonniere@univ-pau.fr
b Laboratoire d’Electrochimie et Chimie Analytique, CNRS UMR-7575, Ecole Nationale Supérieure de Chimie de Paris, 11 rue P. et M. Curie, Paris CEDEX 05, France
We present quantum mechanical (QM) vibrational computations beyond the harmonic approximation for an
P. Carbonniere, A. Dargelos, I. Ciofini, C. Adamo and C. Pouchan, Phys. Chem. Chem. Phys., 2009, 11, 4375 DOI: 10.1039/B817468G
To request permission to reproduce material from this article, please go to the Copyright Clearance Center request page.
If you are an author contributing to an RSC publication, you do not need to request permission provided correct acknowledgement is given.
If you are the author of this article, you do not need to request permission to reproduce figures and diagrams provided correct acknowledgement is given. If you want to reproduce the whole article in a third-party publication (excluding your thesis/dissertation for which permission is not required) please go to the Copyright Clearance Center request page.
Read more about how to correctly acknowledge RSC content.
Fetching data from CrossRef.
This may take some time to load.
Loading related content