0479628 - ÚOCHB 2018 RIV US eng J - Journal Article
Bettanin, F. - Ferrao, L. F. A. - Pinheiro Jr., M. - Aquino, A. J. A. - Lischka, H. - Machado, F. B. C. - Nachtigallová, Dana
Singlet L-a and L-b Bands for N-Acenes (N = 2-7): A CASSCF/CASPT2 Study.
Journal of Chemical Theory and Computation. Roč. 13, č. 9 (2017), s. 4297-4306. ISSN 1549-9618. E-ISSN 1549-9626
R&D Projects: GA ČR(CZ) GA16-16959S
Institutional support: RVO:61388963
Keywords : polycyclic aromatic hydrocarbons * density functional theory * theory/multireference configuration interaction
OECD category: Physical chemistry
Impact factor: 5.399, year: 2017
Permanent Link: http://hdl.handle.net/11104/0275606
Bettanin, F. - Ferrao, L. F. A. - Pinheiro Jr., M. - Aquino, A. J. A. - Lischka, H. - Machado, F. B. C. - Nachtigallová, Dana
Singlet L-a and L-b Bands for N-Acenes (N = 2-7): A CASSCF/CASPT2 Study.
Journal of Chemical Theory and Computation. Roč. 13, č. 9 (2017), s. 4297-4306. ISSN 1549-9618. E-ISSN 1549-9626
R&D Projects: GA ČR(CZ) GA16-16959S
Institutional support: RVO:61388963
Keywords : polycyclic aromatic hydrocarbons * density functional theory * theory/multireference configuration interaction
OECD category: Physical chemistry
Impact factor: 5.399, year: 2017
Permanent Link: http://hdl.handle.net/11104/0275606