| Titre : |
QUANTUM THEORY OF CHEMICAL REACTIONS : CHEMISORPTION, CATALYSIS, BIOCHEMICAL REACTIONS |
| Type de document : |
texte imprimé |
| Auteurs : |
Raymond Daudel, Éditeur scientifique |
| Editeur : |
Dordrecht [Hollande] : Reidel |
| Année de publication : |
1982 |
| ISBN/ISSN/EAN : |
978-90-277-1467-1 |
| Langues : |
Anglais (eng) |
| Catégories : |
AC.00 Metaux de transition et organometalliques
|
| Mots-clés : |
THEORETICAL CHEMISTRY REACTIVITY TRANSITION METALS AND ALLOYS CATALYSISAB INITIO CALCULATIONS SOLVATION |
| Index. décimale : |
AC.00 |
| Résumé : |
1- THEORETICAL BACKGROUND OF HETEROGENEOUS CATALYSIS 2- ANALYSIS OF CO METAL CLUSTER INTERACTION ENERGIES BY THE HARTREE FOCK SLATER METHOD 3CHEMISORPTION PROPERTIES OF TRANSITION METAL CLUSTERS 4- GAS, ORGANIC SOLID STATE REACTIONS AND THEIR APPLICATIONS 5- SOME THEORETICAL QUESTIONS CONCERNING THE MECHANISM OF FISCHER TROPSCH SYNTHESIS 6- ENVIRONMENTAL EFFECTS ON PROTON TRANSFER. AB INITIO CALCULATIONS ON SYSTEMS IN A SEMI-CLASSICAL, POLARIZABLE ENVIRONMENT 7- RECENT QUANTUM STATISTICAL MECHANICAL STUDIES ON ENZYME ACTIVITIY SERINE PROTEASES AND ALCOHOL DEHYDROGENASES 8- APPLICATIONS OF QUANTUM CHEMISTRY TO PHARMACOLOGY 9- ON THE PHARMACOPHORE AND MODE OF ACTIONS OF SOME SCHISTOSOMICIDAL AGENTS 10- INERMOLECULAR INTERACTIONS AND SOLVENT EFFECTS: SIMPLIFIED THEORETICAL METHODS |
QUANTUM THEORY OF CHEMICAL REACTIONS (1982)
