On the origin of the shift between vertical excitation and band maximum in molecular photoabsorption.

Bai, Shuming; Mansour, Ritam; Stojanovic, Ljiljana; Toldo, Josene M; Barbatti, Mario.

Afiliação

Bai S; Aix Marseille University, CNRS, ICR, Marseille, France. shuming.bai@duke.edu.
Mansour R; Department of Chemistry, Duke University, Durham, NC, 27708, USA. shuming.bai@duke.edu.
Stojanovic L; Aix Marseille University, CNRS, ICR, Marseille, France.
Toldo JM; Aix Marseille University, CNRS, ICR, Marseille, France.
Barbatti M; School of Biological and Chemical Sciences, Queen Mary University of London, Mile End Road, London, E1 4NS, UK.

J Mol Model ; 26(5): 107, 2020 Apr 21.

Article em En | MEDLINE | ID: mdl-32318882