Reaction kinetics and the development and operation of catalytic processes: proceedings of the 3rd international symposium, Oostende

G.F. Froment and K.C. Waugh (Eds.)9780444505590, 0-444-50559-8

Reaction Kinetics and the Development and Operation of Catalytic Processes is a trendsetter. The Keynote Lectures have been authored by top scientists and cover a broad range of topics like fundamental aspects of surface chemistry, in particular dynamics and spillover, the modeling of reaction mechanisms, with special focus on the importance of transient experimentation and the application of kinetics in reactor design. Fundamental and applied kinetic studies are well represented. More than half of these deal with transient kinetics, a new trend made possible by recent sophisticated experimental equipment and the awareness that transient experimentation provides more information and insight into the microphenomena occurring on the catalyst surface than steady state techniques. The trend is not limited to purely kinetic studies since the great majority of the papers dealing with reactors also focus on transients and even deliberate transient operation. It is to be expected that this trend will continue and amplify as the community becomes more aware of the predictive potential of fundamental kinetics when combined with detailed realistic modeling of the reactor operation.

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Table of contents :
Content:
Introduction
Page xiii
G.F. Froment, K.C. Waugh

Adventures in Catalytic Nanospace: ‘Seeing’ spillover in-situ for thefirst time Original Research Article
Pages 3-17
Michael Bowker, Roger A. Bennett, Amanda Dickinson, David James, Rupert D. Smith, Peter Stone

From first-principles to catalytic turnovers: Ethylene hydrogenation overpalladium Original Research Article
Pages 19-40
Matthew Neurock, Eric Hansen, Donghai Mei, Pallassana S. Venkataraman

Development of microkinetic expressions by instationary methods Original Research Article
Pages 41-55
Frerich J. Keil

Self sustained oscillations over copper in the catalyticoxidation of methanol Original Research Article
Pages 57-70
I. Böttger, B. Pettinger, Th. Schedel-Niedrig, A. Knop-Gericke, R. Schlögl

Novel reactor configurations and modes of operation Original Research Article
Pages 71-85
Dan Luss

New methodologies and reactors for catalytic process development Original Research Article
Pages 87-101
M.P. Harold, P.L. Mills, J.F. Nicole

Hysteresis kinetics of propene oxidation characterized bya Ag-Re supported membrane reactor Original Research Article
Pages 105-112
Masayoshi Kobayashi, Tohru Kanno, Jun-ichi Horiuchi, Shigeyuki Hoshi, Noritaka Hattori, Junya Togawa

Kinetics of oxidative dehydrogenation ofLPG to olefins on Dy-Li-CI-Zr-O catalyst Original Research Article
Pages 113-121
M.L. Kaliya, O.V. Malinovskaya, M.V. Landau, M. Herskowitz, P.F. van den Oosterkamp(xab)

De Donder relations and the theory of reaction routes Original Research Article
Pages 123-130
Ilie Fishtik, Ravindra Datta

A kinetic study of NO reduction by CO over a NiO/Al2O3 catalyst Original Research Article
Pages 131-138
T.N. Angelidis, M. Papapetrou

Reaction kinetics of the hydrodenitrogenation of methylcyclohexylamine over fluorinated NiMoS/Al2O3 catalysts Original Research Article
Pages 139-146
Lianglong Qu, Roel Prins

Use of the “dusty-gas” model for the analysis of ethylbenzene oxidehydrogenation process Original Research Article
Pages 147-154
D. Ardissone, A. Bachiller, J. Orejas

Using low melting point alloy intrusion to quantify pore structure:Studies on an alumina catalyst support Original Research Article
Pages 155-162
L. Ruffino, R. Mann, R.J. Oldman, S. Rigby, S. Allen

Mass and heat transfer effects in the kinetic modelling of catalytic cracking Original Research Article
Pages 165-171
P. Hagelberg, V. Alopaeus, K. Lipiäinen, J. Aittama, A.O.L. Krause

Kinetics of ethylene polymerisation over cry zeolites Original Research Article
Pages 173-180
Y. Zhang, X. Wang, M.A.N.D.A. Lemos, F. Lemos, R.T. Henriques, M.M. Marques

Investigations of the selective partial oxidation of methanol and theoxidative coupling of methane over copper catalysts Original Research Article
Pages 181-187
H.-J. Wölk, G. Weinberg, G. Mestl, R. Schlögl

A new kinetic model for hydrodesurfurization of oil products Original Research Article
Pages 189-194
T. Mejdell, R. Myrstad, J. Morud, J.S. Rosvoll, P. Steiner, E.A. Blekkan

Low-temperature, carbon-catalyzed, solvent-washed, trickle-bed sulfuricacid process Original Research Article
Pages 195-203
Peter L. Silveston, Mahiyar A. Panthaky, Kirk Duval, Radu V. Vladea, Ali Lohi, Robert R. Hudgins

Butane oxidation to maleic anhydride over a VPO catalyst following theriser regenerator approach Original Research Article
Pages 205-210
St. Hess, H. Freund, M.A. Liauw, G. Emig

Effects of particle size and modified SAPO-34 on conversion ofmethanol to light olefins and dimethyl ether Original Research Article
Pages 211-218
Michael G. Abraha, Xianchun Wu, Rayford G. Anthony

From DFT calculations to DynamicMonte Carlo simulations. The reactivity of CHx on the Ru(0001) surface Original Research Article
Pages 221-228
I.M. Ciobîcą, F. Frechard, A.P.J. Jansen, R.A. van Santen

Non-steady state operation of trickle-bed reactors Original Research Article
Pages 231-238
J.G. Boelhouwer, H.W. Piepers, A.A.H. Drinkenburg

Performance enhancement of a microchannel reactor under periodic operation Original Research Article
Pages 239-246
André Rouge, Albert Renken

A dynamic study of steam-methane reforming Original Research Article
Pages 247-254
M.A. El-Bousiffi, D.J. Gunn

Model-based optimization of the periodic operation of the Fischer-Tropschsynthesis Original Research Article
Pages 255-262
R.M. de Deugd, S.M. Ypma, F. Kapteijn, F.M. Meeuse, J.A. Moulijn, P.J.T. Verheijen

Direct determination of periodic states of cyclically operated packed bedreactors Original Research Article
Pages 263-270
T.L. van Noorden, S.M. Verduyn Lunel, A. Bliek

Dynamics and control of a radial-flow ammonia synthesis reactor Original Research Article
Pages 271-279
N.S. Schbib, M.N. Pedernera, D.O. Borio

Mass transfer through the gas-liquid interface at the presence of adsorbedactive phospholipid monolayer Original Research Article
Pages 283-288
L. Gradoń, T.R. Sosnowski

Oxygenates and olefins from catalytic partial oxidationof cyclohexane and n-hexane in single-gauze chemical reactors Original Research Article
Pages 289-296
Ryan P. O’Connor, Lanny D. Schmidt

Mechanistic studies of hydroxyl radical-induced catalytic wet oxidation ofdyehouse effluents at atmospheric pressure Original Research Article
Pages 297-302
Dong-Keun Lee, Dul-Sun Kim, Sung-Chul Kim

Reaction pathways of photocatalytic oxidation of PCE in water with theTiO2 film on glass Original Research Article
Pages 303-308
Dong-Keun Lee, In-Cheol Cho

Liquid phase hydrogenation of naphthalene on Ni/Al2O3 Original Research Article
Pages 309-316
P.A. Rautanen, M.S. Lylykangas, J.R. Aittamaa, A.O.I. Krause

Effect of NO and oxygen upon the deactivation of Cu-ZSM-5 in NOdecomposition Original Research Article
Pages 317-324
V.I. Pârvulescu, E. Segal, B. Delmon, P. Grange

Non steady-state production of hydrogen from natural gas: Experiments and modeling Original Research Article
Pages 327-332
E. Odier, Y. Schuurman, H. Zanthoff, C. Millet, C. Mirodatos

Dynamic study of methane interaction with active sites involved in thetotal oxidation of methane over Pd/Al2O3 catalyst Original Research Article
Pages 333-340
S. Fessi, A. Ghorbel, A. Rives, R. Hubaut

A non-stationary kinetics approach for the determination of the kineticparameters of the protolytic cracking of methylcyclohexane Original Research Article
Pages 341-348
V. Fierro, J.L. Duplan, J. Verstraete, Y. Schuurman, C. Mirodatos

Kinetic modelling of transient NO reduction by CO in the presence of 02over an automotive exhaust gas catalyst Original Research Article
Pages 349-356
J.M.A. Harmsen, J.H.B.J. Hoebink, J.C. Schouten

Transient kinetics of 15NO-decomposition on Pt/Al2O3 Original Research Article
Pages 357-364
A.R. Vaccaro, G. Mul, J.A. Moulijn

Transient kinetics of the propene oxidation over silver catalysts Original Research Article
Pages 365-372
A. Zwijnenburg, M. Boer, G. Mul, M. Makkee, J.A. Moulijn

129Xe NMR of adsorbed xenon and 1H NMR) imaging: new methods to study the diffusion of gaseous hydrocarbons in a fixed bed of zeolite Original Research Article
Pages 375-382
P. N’Gokoli-Kekele, M.-A. Springer-Huet, J.-L. Bonardet, J.-M. Dereppe, J. Fraissard

Catalytic activity of carbon nanotubes and other carbon materials foroxidative dehydrogenation of ethylbenzene to styrene Original Research Article
Pages 383-389
N. Maksimova, G. Mestl, R. Schlögl

Heterogeneous catalysis at high temperature for spaceapplications Original Research Article
Pages 391-398
M. Balat-Pichelin, J.M. Badie

Catalyst design for reactions with synthesis gas Original Research Article
Pages 399-407
G.P. Valença, E.S. Gonçalves

Enhancement of non isothermal autocatalytic reactions by intraparticlediffusion Original Research Article
Pages 411-417
M. Grzesik, J. Skrzypek

An adsorptive reactor for operation of exothermic seriesreactions Original Research Article
Pages 419-426
A.J. Kodde, A. Bliek

Catalytic activity and characterization of quaternaryammonium(methylstyrene-co-styrene) resin in an organic solvent/alkaline solution Original Research Article
Pages 429-433
Ho-Shing Wu, Chun-Shen Lee

Catalyst development for methanol and dimethyl ether production fromblast furnace off gas Original Research Article
Pages 435-443
Jun-ichiro Yagi, Tomohiro Akiyama, Atsushi Muramatsu

Heterogeneous photo- and thermal catalytic oxidation of co: effects ofmetal deposition Original Research Article
Pages 445-451
I. Ozen, D. Uner

Harmonization of the empirical information on the de-NOx catalysts for thecomparison of the catalyst performance through reaction modeling Original Research Article
Pages 453-458
D. Uner, S. Kaya

Synthesis of Cumene (Isopropylbenzene) from Diisopropylbenzenes in thepresence of Benzene using Triflic acid as catalyst at room temperature Original Research Article
Pages 459-464
M.C. Al-Kinany, S.H. Al-Khowaiter, F.H. Al-Malki

Diffusion analysis of cumene cracking over ZSM5 using a jetloop reactor Original Research Article
Pages 465-470
P. Schwan, P.J. Henry, K.P. Möller

Simulation of the effect of mass transfer limitations in complex gas-liquidreactions Original Research Article
Pages 471-476
M. Pisu, A. Cincotti, G. Cao, F. Pepe

Evaluation of external diffusional effects in a microreactor for SRGOhydrotreating Original Research Article
Pages 477-480
L.C. Castañeda-López, F. Alonso-Martínez, J. Ancheyta-Juárez

A study of a phase transfer catalytic reaction between n-butylbromide and sodium phenolate in an oscillatory baffled reactor Original Research Article
Pages 481-487
B. Wilson, X. Ni, D.C. Sherrington

Kinetics of the main and side reactions of the methanoloxidation over iron molybdates Original Research Article
Pages 489-494
A.P. Vieira Soares, M. Farinha Portela, A. Kiennemann

Mechanistic investigations of oxidation of purineand pyrimidine base components of nucleic acids by bromamine-b in aqueous alkaline medium : a kinetic approach Original Research Article
Pages 495-500
Nirmala Vaz, Puttaswamy

Activity-acidity relationships in solid acid catalysis — a quantumchemical study Original Research Article
Pages 501-506
X. Wang, M.A.N.D.A. Lemos, F. Lemos, F. Ramôa Ribeiro

Catalytic reactions mechanisms with somenonlinear conservation laws Original Research Article
Pages 507-508
E.S. Patmar, N.I. Koltsov

Modelling diffusion, cracking reactions and deactivation in FCC Catalysts Original Research Article
Pages 509-514
F. López-Isunza, N. Moreno-Montiel, R. Quintana-Solórzano, J.C. Moreno-Mayorga, F. Hernández-Beltrán

Oxidehyrogenation of ethylbenzene to styrene on P-O-Ni-Mn/Alumina catalysts Original Research Article
Pages 515-520
D. Ardissone, A. Bachiller, M. Ponzi, J. Orejas

Hydrodechlorination of chlorobenzene-tetrachloroethylenemixtures over a Pd/Al2O3 catalyst Original Research Article
Pages 521-526
E. López, S. Ordóñez, F.V. Díez, H. Sastre

Kinetic study of the liquid-phase hydrogenation of 1,3-butadiene and n-buteneson a commercial Pd/Al2O3 catalyst Original Research Article
Pages 527-534
N.O. Ardiaca, S.P. Bressa, J.A. Alves, O.M. Martínez, G.F. Barreto

Kinetics and mechanism of Ruthenium(III) andOsmium(VIII) catalyzed oxidation of dopamine with broiviamine-B in acid and alkaline media Original Research Article
Pages 535-540
Puttaswamy, Nirmala Vaz

Kinetic models for esterification of methacrylic acid using n-propanol andisopropanol Original Research Article
Pages 541-545
M. Grzesik, J. Skrzypek, M. Witczak

Kinetics models for esterification of levulinic acid with 2-ethylhexanolusing different catalysts Original Research Article
Pages 547-551
M. Grzesik, T. Gumula

Time Resolution of the TAP reactor Original Research Article
Pages 553-557
Dezheng Wang, Zhonglai Li

A novel catalyst preparation and kinetic study on the dechlorination ofchlorinated hydrocarbons Original Research Article
Pages 559-564
Young Sung Cho, Jong-Chul Park, Byung-Seok Choi, Jungwoo Moon, Jongheop Yi

Kinetics of copolyesters of poly(butyleneterephthalate), hydroquinone diacetate and terephthalic acid: A simple rate model for catalysed synthesis in melt Original Research Article
Pages 565-574
Amir Al-Haddad, Johnson Mathew

Catalytic oxidation of sulfite/bisulfite in a falling-film absorptioncolumn Original Research Article
Pages 575-580
M. Vorbach, R. Marr, M. Siebenhofer

Influence of fluorination on the kinetics of the HDN of o-toluidine overtungsten sulfide catalysts ex ammonium tetrathiotungstate Original Research Article
Pages 581-586
Mingyong Sun, Roel Prins

Kinetics of the hydrodenitrogenation of cyclohexylamineover sulfided NiMo/γ-Al2O3 Original Research Article
Pages 587-592
Fabio Rota, Roel Prins

H2-TPR kinetics; Case study on the reduction of a CrOx/Al2O3 catalyst Original Research Article
Pages 593-598
J.M. Kanervo, A.O.I. Krause

Kinetic study of methane combustion over La0,9Ce0,1CoO3 Original Research Article
Pages 599-604
R. Auer, L. Warnier, F.C. Thyrion

Theoretical determination of the kinetic parameters of a reactionintermediate by degeneration of the precursor process Original Research Article
Pages 605-609
M. Elkhatib, C. Duriche, R. Metz, J.R. Vignalou, H. Delalu

An easy methodology for estimating kinetic constants in complex kineticmodels Original Research Article
Pages 611-614
J. Ancheyta-Juárez, R. Sotelo-Boyás

Experimental validation of a kinetic model for naphtha reforming Original Research Article
Pages 615-618
J. Ancheyta-Juárez, E. Villafuerte-Macías

Kinetic analysis of enzymatic esterification of fatty acids and ethanol Original Research Article
Pages 619-624
V.U. Miguel, G.C. Trubiano, G. Perez, D.O. Borio, A.F. Errazu

Catalytic combustion of methane over Pd/γ-Al2O3 in a monolithic reactor:kinetic study Original Research Article
Pages 625-630
Eduardo López, Carlos Gígola, Daniel O. Borio, Verónica Bucalá

Software functionality assessment for kinetic reactionmodel development, model discrimination, parameter estimation and design of experiments Original Research Article
Pages 631-636
Rob J. Berger, Johan Hoorn, Jan Verstraete, Jan Willem Verwijs

Author index
Pages 637-639