Zobrazeno 1 - 1
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pro vyhledávání: '"Delphine Moulin"'
Autor:
Diane Bousquet, Fréderic Baltenneck, Priscilla Riva, Aziz Fadli, Stefania Di Tommaso, Carlo Adamo, Delphine Moulin, Herve David, Jérôme Gomar, Ilaria Ciofini
Publikováno v:
Journal of computational chemistry. 38(13)
Aiming at developing an affordable and easily implementable computational protocol for routine prediction of spectral properties of rigid molecular dyes, density functional theory, and time-dependent density functional theory were used in conjunction