Skip to main content
3 of 5
cleaned up format

ADF

With the Amsterdam Modeling Suite you can calculate (ADF, DFTB) and plot NBOs in the graphical user interface within the same package.
Some examples:
NBO + NMR analysis
TDDFT UV/VIS, including NTOs and NBOs
NBO and other analyses (QTAIM)

Welcome to give it a try