Potential of Sumanene Modified with Boron and Nitrogen Atoms for Adsorption of Carbon Dioxide: DFT and SAPT Study

Affiliations

Stevan Armaković: Department of Physics, Faculty of Sciences, University of Novi Sad, 21000 Novi Sad, Serbia
Sanja J. Armaković: Department of Chemistry, Biochemistry and Environmental Protection, Faculty of Sciences, University of Novi Sad, 21000 Novi Sad, Serbia
Sonja Skuban: Department of Physics, Faculty of Sciences, University of Novi Sad, 21000 Novi Sad, Serbia
Elvira Đurđić: Department of Physics, Faculty of Sciences, University of Novi Sad, 21000 Novi Sad, Serbia
Stevan Jankov: Department of Physics, Faculty of Sciences, University of Novi Sad, 21000 Novi Sad, Serbia
Željka Cvejić: Department of Physics, Faculty of Sciences, University of Novi Sad, 21000 Novi Sad, Serbia

Abstract

Buckybowls are organic, curved and bowl-shaped molecules whose main representatives arecorannulene and sumanene [...]