[en] In a recent study [Angew. Chem. Int. Ed. 62, e202312078 (2023)], it was suggested that the maxima of the dipole polarizability along the bond dissociation coordinate can be used to...
Research center :
ULHPC - University of Luxembourg: High Performance Computing
Disciplines :
Chemistry
Author, co-author :
CHARRY MARTINEZ, Jorge Alfonso ; University of Luxembourg > Faculty of Science, Technology and Medicine > Department of Physics and Materials Science > Team Alexandre TKATCHENKO
BARBORINI, Matteo ; University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > HPC Platform
TKATCHENKO, Alexandre ; University of Luxembourg > Faculty of Science, Technology and Medicine (FSTM) > Department of Physics and Materials Science (DPHYMS)
External co-authors :
yes
Language :
English
Title :
Unraveling chemical bonding mechanisms through dipole moment variations under external electric fields
