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pro vyhledávání: '"Gustavo M. dos Santos"'
Autor:
Bruno D. Milanez, Gustavo M. dos Santos, Max Pinheiro, Leonardo T. Ueno, Luiz F. A. Ferrão, Adelia J. A. Aquino, Hans Lischka, Francisco B. C. Machado
Publikováno v:
Journal of Computational Chemistry. 44:755-765
Autor:
Bruno D, Milanez, Gustavo M, Dos Santos, Max, Pinheiro, Leonardo T, Ueno, Luiz F A, Ferrão, Adelia J A, Aquino, Hans, Lischka, Francisco B C, Machado
Publikováno v:
Journal of computational chemistryREFERENCES.
The chemical stability and the low-lying singlet and triplet excited states of BN-n-acenes (n = 1-7) were studied using single reference and multireference methodologies. From the calculations, descriptors such as the singlet-triplet splitting, the n