Zobrazeno 1 - 2
of 2
pro vyhledávání: '"94(62)"'
Autor:
Van Speybroeck, Veronique1,2, Van der Mynsbrugge, Jeroen1,2, Vandichel, Matthias1,2, Hemelsoet, Karen1,2, Lesthaeghe, David1,2, Ghysels, An1,2, Marin, Guy B.3, Waroquier, Michel1,2
Publikováno v:
Journal of the American Chemical Society. 2/2/2011, Vol. 133 Issue 4, p888-899. 12p.
Autor:
Matthias Vandichel, David Lesthaeghe, Jeroen Van der Mynsbrugge, Michel Waroquier, Karen Hemelsoet, Veronique Van Speybroeck, An Ghysels, Guy B. Marin
Publikováno v:
Journal of the American Chemical Society
Methylations of ethene, propene, and butene by methanol over the acidic microporous H-ZSM-5 catalyst are studied by means of state of the art computational techniques, to derive Arrhenius plots and rate constants from first principles that can direct