Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.
Absorption spectra in vacuo (dotted) and in toluene solution (solid line) calculated with different DFT XC functionals (PBE0: brown, CAM-B3LYP: black) in the statistical approach, compared to the static approach (placemarks) and to the experimental spectrum. The same normalization was used for all the computed spectra.
