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Autor:
Yaya, A., Ewels, C.P., Efavi, K., Agyei-Tuffour, B., Kan-Dapaah, K., Onwona-Agyeman, B., Abavare, E.K.K., Hassanali, Ali, Briddon, P.R., Mattia, Davide
Publikováno v:
Cogent Engineering, Vol 3, Iss 1 (2016)
Cogent Engineering
Cogent Engineering, Cogent OA, 2016, 3 (1), ⟨10.1080/23311916.2016.1261509⟩
Cogent Engineering
Cogent Engineering, Cogent OA, 2016, 3 (1), ⟨10.1080/23311916.2016.1261509⟩
We use a density functional theory approach under the local density approximation (DFT/LDA) to describe the formation of polybromide chain structures, their stretching frequency modes and charge transfer induced by the interaction of these molecules