Kinetic Network Modeling of the Catalytic Upgrading of Biomass's Acetate Fraction to Aromatics
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We have investigated different possible mechanisms for the cis-trans isomerization in triply bonded ditungsten complexes with stoichiometry W2Cl4(NHEt)2(PMe3)2 using static d. functional calcns. as well as Car-Parrinello simulations. Our studies reveal an ...
2001
This thesis deals with a laboratory study of heterogeneous reactions involving bromine and chlorine containing reservoir species on alkali salt substrates which are relevant to the marine boundary layer, and on ice substrates which are relevant to the lowe ...
EPFL2001
Chemical systems with standard reaction enthalpies (ΔH0r) and an activation energies (Ea) of a few tens of kcal/mol are generally well described by the unimolecular reaction rate theory. The goal of this work is to determine the limits of this model by stu ...
EPFL1992
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One-step hydroxylation of benzene to phenol by N2O has been performed over structured catalytic beds made of ZSM-5 coatings on stainless steel grids. The catalysts demonstrated high activity with a selectivity toward phenol formation of 98%. A detailed kin ...
2001
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The use of formate-based ammonia precursors as alternatives to urea in the selective catalytic reduction (SCR) process requires that formic acid released upon their thermolysis in the hot exhaust is rapidly decomposed to carbon dioxide. This work aims at t ...
