On surface heterogeneity and catalytic kinetics

Industrial and Engineering Chemistry Research

Volumn 44, Issue 6, 2005, Pages 1688-1697

  Murzin, Dmitry Yu ^a  

^a LABORATORY OF INDUSTRIAL CHEMISTRY AND REACTION ENGINEERING   (Finland)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION ISOTHERMS; CALORIMETRY; CHEMISORPTION; DATA REDUCTION; REACTION KINETICS; SURFACE CHEMISTRY;

CATALYTIC ENGINEERING; HETEROGENEOUS CATALYTIC REACTIONS; LANGMUIR-HINSHELWOOD KINETICS; SURFACE HETEROGENEITY;

CATALYSIS;

BENZENE; HYDROGEN; PLATINUM;

CATALYST;

ADSORPTION; ARTICLE; CALORIMETRY; CATALYSIS; CHEMICAL REACTION KINETICS; CRYSTAL STRUCTURE; LANGMUIR BLODGETT FILM; MATHEMATICAL ANALYSIS; NANOPARTICLE; PARTICLE SIZE; PHYSICOCHEMICAL MODEL; POWDER; SURFACE PROPERTY; THERMODYNAMICS;

EID: 14844350964     PISSN: 08885885     EISSN: None     Source Type: Journal    
DOI: 10.1021/ie049044x     Document Type: Article

References (93)

1. Brown, W. A.; Kose, R.; King, D. A. Calorimetric measurements of the adsorption heat for ethene on Pt{211} and Pt{311}. Surf. Sci. 1999, 440, 271.
2. Chorkendorff, I.; Niemantsverdriet, J. W. Concepts of modern catalysis and kinetics; Wiley-VCH: Weinheim, Germany, 2003.
3. Dooling, D. J.; Rekoske, J. E.; Broadbelt, L. J. Microkinetic models of catalytic reactions on nonuniform surfaces: Application to model and real systems. Langmuir 1999, 15, 5846.
4. Dooling, D. J.; Broadbelt, L. J. Microkinetic models and dynamic Monte Carlo simulations of nonuniform catalytic systems. AIChE J. 2001, 47, 1193.
5. Duca, D.; Barone, G.; Varga, Z.; Manna, G. L. Hydrogenation of light hydrocarbons on palladium: theoretical study of the local surface arrangements. THEOCHEM 2001, 542, 207.
6. Ertl, G. Heterogeneous catalysis on atomic scale. J. Mol. Catal. A: Chem. 2002, 182-183, 5.
7. Ertl, G. Heterogeneous catalysis on the atomic scale. Chem. Rec. 2001, 1, 33.
8. Ge, Q.; Kose, R.; King, D. A. Adsorption energetics and bonding from femtomole calorimetry and from first principles theory. Adv. Catal. 2000, 45, 207.
9. Hammer, B.; Norskov, J. K. Theoretical surface science and catalysis - calculations and concepts. Adv. Catal. 2000, 45, 71.
10. Hansen, E.; Neurock, M. Predicting lateral surface interactions through density functional theory: application to oxygen on Rh(100). Surf. Sci. 1999, 441, 410.
11. Hansen, E. W.; Neurock, M. Modeling surface kinetics with first-principles-based molecular simulation. Chem. Eng. Sci. 1999, 54, 3411.
12. Hildebrand, M.; Mikhailov, A. S.; Ertl, G. Traveling nanoscale structures in reactive adsorbates with attractive lateral interactions. Phys. Rev. Lett. 1998, 81, 2602.
13. Johannessen, T.; Larsen, J. H.; Chorkendorff, I.; Livbjerg, H.; Topsøe, H. Catalyst dynamics. Consequences for classical kinetic descriptions of reactors. Chem. Eng. J. 2001, 82, 219.
14. Kose, R.; Brown, W. A.; King, D. A. Role of lateral interactions in adsorption kinetics: CO/Rh{100}. J. Phys. Chem. B 1999, 103, 8722.
15. 2 on Rh{100}. Surf. Sci. 1998, 402-404, 856.
16. Lombardo, S. J.; Bell, A. T. A review of theoretical models for adsorption, diffusion, desorption and reaction of gases on metals. Surf. Sci. Rep. 1991, 13, 1.
17. 2/Pt(100) reaction: "Surface explosion", kinetic oscillations, and chaos. J. Chem. Phys. 1998, 108, 3740.
18. Murzin, D. Yu. Modeling of adsorption and kinetics in catalysis over induced nonuniform surfaces: surface electronic gas model. Ind. Eng. Chem. Res. 1995, 34, 1208.
19. Nieskens, D. L. S.; van Bavel, A. P.; Niemantsverdriet, J. W. The analysis of temperature programmed desorption experiments of systems with lateral interactions; implications of the compensation effect. Surf. Sci. 2003, 546, 159.
20. 2 oxidation over platinum. J. Phys. Chem. A 1999, 103, 8101.
21. Rudzinski, W.; Haber, J. Fourth International Symposium: Effects of surface heterogeneity in adsorption and catalysis on solids-ISSHAC IV, Krakow, Poland, 2001. Appl. Surf. Sci. 2002, 196, 1.
22. Temkin, M. I. The kinetics of some industrial heterogeneous catalytic reactions. Adv. Catal. 1979, 28, 173.
23. Tovbin, Yu. K. Lattice-gas model in kinetic theory of gas-solid interface processes. Prog. Surf. Sci. 1990, 34, 1.
24. Somorjai, G. A.; Carrazza, J. Structure sensitivity of catalytic reactions. Ind. Eng. Chem. Fundam. 1986, 25, 63.
25. Somorjai, G. A. The development of molecular surface science and the surface science of catalysis: The Berkeley contribution. J. Phys. Chem. B 2000, 104, 2969.
26. van Bavel, A. P.; Hermse, C. G. M.; Hopstaken, M. J. P.; Jansen, A. P. J.; Lukkien, J. J.; Hilbers, P. A. J.; Niemantsverdriet, J. W. Quantifying lateral adsorbate interactions by kinetic Monte Carlo simulations and density-functional theory: NO dissociation on Rh(100). Phys. Chem. Chem. Phys. 2004, 6, 1830.
27. Zhdanov, V. P. Arrhenius parameters for rate processes on solid surfaces. Surf. Sci. Rep. 1991, 12, 183.
28. Zhdanov, V. P. Monte Carlo simulations of oscillations, chaos and pattern formation in heterogeneous catalytic reactions. Surf. Sci. Rep. 2002, 45, 231.
29. Zhdanov, V. P. Impact of surface science on the understanding of kinetics of heterogeneous catalytic reactions. Surf. Sci. 2002, 500, 966.
30. Zhdanov, V. P. Pattern formation in catalytic reactions due to lateral adsorbate-adsorbate interactions. Langmuir 2001, 17, 1793.
31. Ostrovskii, V. E. "Paradox of heterogeneous catalysis": Paradox or regularity? Ind. Eng. Chem. Res. 2004, 43, 3113.
32. 2 catalysts. Dependence on support and on metal particle size. Thermochim. Acta 1998, 312, 115.
33. Spiewak, B. E.; Dumesic, J. A. Applications of adsorption microcalorimetry for the characterization of metal-based catalysts. Thermochim. Acta 1998, 312, 95.
34. Cortright, R. D.; Dumesic, J. A. L-zeolite-supported platinum and platinum/tin catalysts for isobutane dehydrogenation. Appl. Catal. A 1995, 129, 101.
35. Spiewak, B. E.; Dumesic, J. A. Microcalorimetric measurements of differential heats of adsorption on reactive catalyst surfaces. Thermochim. Acta 1996, 290, 43.
36. Silvestre-Albero, J.; Sanchez-Castillo, M. A.; He, R.; Sepulveda-Escribano, A.; Rodriguez-Reinoso, F.; Dumesic, J. A. Microcalorimetric, reaction kinetics and DFT studies of Pt-Zn/X-zeolite for isobutane dehydrogenation. Catal. Lett. 2001, 74, 17.
37. 2 catalysts. J. Phys. Chem. B 1999, 103, 3923.
38. 2 adsorption on Pt powder. J. Catal. 1998, 176, 405.
39. Borroni-Bird, C. E.; King, D. A. An ultrahigh vacuum single-crystal adsorption microcalorimeter. Rev. Sci. Instrum. 1991, 62, 2177.
40. Stuckless, J. T.; Frei, N. A.; Campbell, C. T. A novel single-crystal adsorption calorimeter and additions for determining metal adsorption and adhesion energies. Rev. Sci. Instrum. 1998, 69, 2427.
41. Stuck, A.; Wartnaby, E. C.; Yeo, Y. Y.; King, D. A. Microcalorimetric study of ethylene on Pt{110}-(1 x 2). Phys. Rev. Lett. 1995, 74, 578.
42. Ihm, H.; Ajo, H. M.; Gottfried, J. M.; Bera, P.; Campbell, C. T. Calorimetric measurement of the heat of adsorption of benzene on Pt(111). J. Phys. Chem. B 2004, 108, 14627.
43. Ertl, G. Dynamics of reactions at surfaces. Adv. Catal. 2000, 45, 1.
44. Gai, P. L.; Roper, R.; White, M. G. Recent advances in nanocatalysis research. Curr. Opin. Solid State Mater. Sci. 2002, 6, 401.
45. Henry, C. R. Catalytic activity of supported nanometer-sized metal clusters. Appl. Surf. Sci. 2000, 164, 252. Rioux, R. M.; Song, H.; Hoefelmeyer, J. D.; Yang, P.; Somorjai, G. A. High-surface-area catalyst design: Synthesis, characterization, and reaction studies of platinum nanoparticles in mesoporous SBA-15 silica. J. Phys. Chem. B, in press. Zhou, B., Hermans, S., Somorjai, G. A., Eds. Nanotechnology in Catalysis; Kluwer Academic/Plenum Publishers: New York, 2004; Vols. 1 and 2, pp 194 and 360.
46. Henry, C. R. Catalytic activity of supported nanometer-sized metal clusters. Appl. Surf. Sci. 2000, 164, 252. Rioux, R. M.; Song, H.; Hoefelmeyer, J. D.; Yang, P.; Somorjai, G. A. High-surface-area catalyst design: Synthesis, characterization, and reaction studies of platinum nanoparticles in mesoporous SBA-15 silica. J. Phys. Chem. B, in press. Zhou, B., Hermans, S., Somorjai, G. A., Eds. Nanotechnology in Catalysis; Kluwer Academic/Plenum Publishers: New York, 2004; Vols. 1 and 2, pp 194 and 360.
47. Henry, C. R. Catalytic activity of supported nanometer-sized metal clusters. Appl. Surf. Sci. 2000, 164, 252. Rioux, R. M.; Song, H.; Hoefelmeyer, J. D.; Yang, P.; Somorjai, G. A. High-surface-area catalyst design: Synthesis, characterization, and reaction studies of platinum nanoparticles in mesoporous SBA-15 silica. J. Phys. Chem. B, in press. Zhou, B., Hermans, S., Somorjai, G. A., Eds. Nanotechnology in Catalysis; Kluwer Academic/Plenum Publishers: New York, 2004; Vols. 1 and 2, pp 194 and 360.
48. Haruta, M. Catalysis of gold nanoparticles deposited on metal oxides. Cattech 2002, 6, 102.
49. Schimpf, S.; Lucas, M.; Mohr, C.; Rodemerck, U.; Brückner, A.; Radnik, J.; Hofmeister, H.; Claus, P. Supported gold nanoparticles: in-depth catalyst characterization and application in hydrogenation and oxidation reactions. Catal. Today 2002, 72, 63.
50. Zhdanov, V. P.; Kasemo, B. Simulations of the reaction kinetics on nanometer-sized supported catalyst particles. Catalysis and Electrocatalysis at Nanoparticle Surfaces; Marcel Dekker: New York, 2003; p 35. Zhdanov, V. P.; Kasemo, B. Simulations of the reaction kinetics on nanometer supported catalyst particles. Surf. Sci. Rep. 2000, 39, 25.
51. Zhdanov, V. P.; Kasemo, B. Simulations of the reaction kinetics on nanometer-sized supported catalyst particles. Catalysis and Electrocatalysis at Nanoparticle Surfaces; Marcel Dekker: New York, 2003; p 35. Zhdanov, V. P.; Kasemo, B. Simulations of the reaction kinetics on nanometer supported catalyst particles. Surf. Sci. Rep. 2000, 39, 25.
52. McLeod, A. S.; Gladden, L. F. Monte Carlo simulation of kinetic discontinuities in hydrocarbon hydrogenation reactions. Catal. Lett. 1997, 43, 189. McLeod, A. S. The influence of catalyst geometry and topology on the kinetics of hydrocarbon reactions. Chem. Eng. Res. Des. 2004, 82, 945.
53. McLeod, A. S.; Gladden, L. F. Monte Carlo simulation of kinetic discontinuities in hydrocarbon hydrogenation reactions. Catal. Lett. 1997, 43, 189. McLeod, A. S. The influence of catalyst geometry and topology on the kinetics of hydrocarbon reactions. Chem. Eng. Res. Des. 2004, 82, 945.
54. Riahi, G.; Guillemot, D.; Polisset-Rhfoin, M.; Khodadadi, A. A.; Fraissard, J. Preparation, characterization and catalytic activity of gold-based nanoparticles on HY zeolites. Catal. Today 2002, 72, 115.
55. Yuranov, I.; Moeckli, P.; Suvorova, E.; Buffat, P.; Kiwi-Minsker, L.; Renken, A. Pd/SiO2 catalysts: synthesis of Pd nanoparticles with the controlled size in mesoporous silicas. J. Mol. Catal. A: Chem. 2003, 192, 239.
56. Boddenberg, B.; Rakhmatkariev, G. U.; Wozniak, A.; Hufnagel, S. A calorimetric and statistical mechanics study of ammonia adsorption in zeolite NaY. Phys. Chem. Chem. Phys. 2004, 6, 2494.
57. Cardona-Martinez, N.; Dumesic, J. A. Applications of adsorption microcalorimetry to the study of heterogeneous catalysis. Adv. Catal. 1992, 38, 149.
58. Kul'kova, N. V.; Kvyatkovskaya, M. Yu.; Murzin, D. Yu. Liquid-phase ammoximation of cyclohexanone. 3. Ammonia adsorption on ammoximation catalysts. Khim. Prom. 1997, 28.
59. In several years as a Ph.D. student and a research associate of Prof. M. I. Temkin, the present author witnessed many times that he repeatedly avoided applying this widely used notion bearing his name for the logarithmic isotherm.
60. Kim, D. J. Adsorption isotherms of 2,2,4-trimethylpentane and toluene vapors on hydrocarbon adsorber and light-off catalyst. J. Colloid Interface Sci. 2004, 269, 290.
61. Sharma, S.; Agarwal, G. P. Interactions of proteins with immobilized metal ions: A comparative analysis using various isotherm models Anal. Biochem. 2001, 288, 126.
62. Johnson, R. D.; Arnold, F. H. The Temkin isotherm describes heterogeneous protein adsorption. Biochim. Biophys. Acta 1995, 1247, 293.
63. Masel, R. I. Chemical kinetics and catalysis; Wiley-Interscience: New York, 2001.
64. Salmi, T.; Murzin, D. Yu.; Mikkola, J.-P.; Wärnå, J.; Mäki-Arvela, P.; Toukoniitty, E.; Toppinen, S. Advanced kinetic concepts and experimental methods for catalytic three-phase processes. Ind. Eng. Chem. Res. 2004, 43, 4540.
65. Temkin, M. I.; Murzin, D. Yu.; Kul'kova, N. V. Kinetics and mechanism of liquid-phase hydrogenation. Dokl. Akad. Nauk SSSR 1988, 303, 659. Murzin, D. Yu.; Kul'kova, N. V. Kinetics and mechanism of the liquid-phase hydrogenation. Kinet. Katal. 1995, 36, 69.
66. Temkin, M. I.; Murzin, D. Yu.; Kul'kova, N. V. Kinetics and mechanism of liquid-phase hydrogenation. Dokl. Akad. Nauk SSSR 1988, 303, 659. Murzin, D. Yu.; Kul'kova, N. V. Kinetics and mechanism of the liquid-phase hydrogenation. Kinet. Katal. 1995, 36, 69.
67. Temkin, M. I. On kinetics and mechanism of ammonia synthesis. Khim. Prom. 1990, 292.
68. Ostrovskii, V. E. Mechanism of ammonia synthesis on iron catalysts near equilibrium. Teor. Eksp. Khim. 1989, 25, 213.
69. (a) Snagovskii, Yu. S.; Ostrovskii, G. M. Modelling of kinetics of heterogeneous catalytic reactions; Moscow, 1976.
70. (b) Snagovskii, Yu. S.; Avetisov, A. K. Multipath kinetics on nonhomogeneous surfaces. Dokl. Akad. Nauk SSSR 1971, 196, 878.
71. (c) Avetisov, A. K.; Bakshi, Yu. M.; Snagovskii, Yu. S.; Gel'bshtein, A. I. Kinetic model of the oxidative dehydrogenation of 1-butene to 1,3-butadiene on iron and tin - antimony oxide catalysts. Kinet. Katal. 1974, 15, 386.
72. Clark, A. The theory of adsorption and catalysis; Academic Press: New York, 1970.
73. Yang, C. H. Statistical-mechanical aspects of adsorption systems obeying the Temkin isotherm. J. Phys. Chem. 1993, 97, 7097.
74. Samarskii, A. A.; Slinko, M. G. Mathematical modeling of heterogeneous catalytic reactions and processes. Russ. Chem. Bull 1998, 47, 1841.
75. Murzin, D. Yu. Computation of reaction rates for catalytic reactions on inhomogeneous surfaces with multicomponent chemisorption. Chem. Eng. Sci. 1996, 51, 155.
76. Murzin, D. Yu. Kinetics of catalytic reactions with two types of sites: nonuniform surfaces. Chem. Eng. Sci. 2002, 57, 1299.
77. Murzin, D. Yu.; Avetisov, A. K. Kinetics of ammonia synthesis close to equilibrium. Ind. Eng. Chem. Res. 1997, 36, 4779.
78. Murzin, D. Yu.; Avetisov, A. K. Deactivation kinetics over induced nonuniform surfaces with linear steps of surface reactions Chem. Eng. Sci. 1998, 53, 2469.
79. Keane, M. A.; Murzin, D. Yu. A kinetic treatment of the gas-phase hydrodechlorination of chlorobenzene over nickel/silica: beyond conventional kinetics. Chem. Eng. Sci. 2001, 56, 3185.
80. Murzin, D. Yu.; Salmi, T. Isothermal multiplicity in catalytic surface reactions with coverage dependent parameters: case of polyatomic species, Chem. Eng. Sci. 1996, 51, 55.
81. Boudart, M. Two-step catalytic reactions. AIChE J. 1972, 18, 465.
82. Kiperman, S. L.; Kumbilieva, K. E.; Petrov, L. A. Classical catalytic kinetics: What is the point of the matter? Ind. Eng. Chem. Res. 1989, 28, 376.
83. Corma, A.; LLopis, F.; Monton, J. B.; Weller, S. W. Comparison of models in heterogeneous catalysis for ideal and non-ideal surfaces. Chem. Eng. Sci. 1988, 43, 785.
84. Ichikawa, S. Heterogeneous catalysis with nonuniformly reactive adsorbates. J. Phys. Chem. 1988, 92, 6970.
85. Laidler, K. Chemical Kinetics; Harper Collins Publishers: New York, 1987.
86. Kraus, M. Linear correlations of substrate reactivity in heterogeneous catalytic reactions. Adv. Catal. 1967, 17, 75.
87. Kraus, M. Organic substituent effects as probes for the mechanism of surface catalysis. Adv. Catal. 1980, 29, 151.
88. Finiels, A.; Geneste, P.; Moreau, C. Transfer of concepts from homogeneous to heterogeneous catalysis: use of Hammett relationships to assess reaction mechanisms and nature of active sites in reactions catalyzed by sulfides, metals, clays and zeolites. J. Mol. Catal. A: Chem. 1996, 107, 385.
89. Bligaard, T.; Nørskov, J. K.; Dahl, S.; Matthiesen, J.; Christensen, C. H.; Sehestad, J. The Brønsted-Evans-Polanyi relation and the volcano curve in heterogeneous catalysis. J. Catal. 2004, 224, 206.
90. Nørskov, J. K.; Bligaard, T.; Logadottir, A.; Bahn, S.; Hansen, L. B.; Bollinger, M.; Bengaard, H.; Hammer, B.; Sljivancanin, Z.;Mavrikakis, M.; Xu, Y.; Dahl, S.; Jacobsen, C. J. H. Universality in heterogeneous catalysis. J. Catal. 2002, 209, 275.
91. Boudart, M. Response to "Classical catalytic kinetics: what is the point of the matter. Ind. Eng. Chem. Res. 1989, 28, 379.
92. Rebrov, E. V.; de Croon, M. H. J. M.; Schouten, J. C. Development of the kinetic model of platinum catalyzed ammonia oxidation in a microreactor. Chem. Eng. J. 2002, 90, 61.
93. Zaera, F. Kinetics of chemical reactions on solid surfaces. Deviations from conventional theory. Acc. Chem Res. 2002, 35, 129.