Chemistry in action: making molecular movies with ultrafast electron diffraction and data science
Auteur :
Liu, Lai Chung
Éditeur :
Springer Nature Switzerland AG
ISBN :
9783030548537
Date de publication :
12 sept. 2021
Dimensions :
23,5 x 15,5 cm
Langue :
Anglais
Pays d'origine :
Suisse
The author shows that there is a simple solution that occurs during barrier crossing in which the highly anharmonic potential at that point in nuclear rearrangements couples high- and low-frequency vibrational modes to give highly localized nuclear motions, reducing hundreds ofpotential degrees of freedom to just a few key modes.