H$_2$, HD and D$_2$ in the small cage of structure II clathrate hydrate: Vibrational frequency shifts from fully coupled quantum six-dimensional calculations of the vibration-translation-rotation eigenstates Auteur(s): Lauvergnat David, Felker Peter, Scribano Y., Benoit David, Bačić Zlatko (Article) Publié: Journal Of Chemical Physics, vol. 150 p.154303 (2019) |