The twelfth Congress on Catalysis was held in Granada (Spain) under the auspices of the International Association of Catalysis Societies and the Spanish Society of Catalysis. These four-volume Proceedings are the expression of the Scientific Sessions which constituted the main body of the Congress. They include 5 plenary lectures, 1 award lecture, 8 keynote lectures, 124 oral presentations and 495 posters. The oral and poster contributions have been selected on the basis of the reports of at least two international reviewers, according to standards comparable to those used for specialised journals.COMPUTATIONAL ANALYSIS The ab initio calculations used involve full geometry optimization of the clusters with density functional theory (dft) as implemented in Jaguar  (Jaguar 3.0, Schrodinger, Inc., Portland, Oregon, 1997) at theanbsp;...
|Title||:||12th International Congress on Catalysis|
|Author||:||A. Corma, F.V. Melo, S. Mendioroz, J.L.G. Fierro|
|Publisher||:||Elsevier - 2000-07-05|