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Volumn 117, Issue 6, 2013, Pages 2879-2887

Molecular mechanism of oxygen isotopic exchange over supported vanadium oxide catalyst VOX/TiO2

Author keywords

[No Author keywords available]

Indexed keywords

ELEY-RIDEAL MECHANISM; EXCHANGE REACTION; GAS-PHASE OXYGEN; LANGMUIR HINSHELWOOD MECHANISM; LATTICE OXYGEN; LATTICE OXYGEN ATOMS; LOW-ACTIVATION ENERGY; MODEL SURFACE; MOLECULAR MECHANISM; MONODENTATES; OXYGEN ISOTOPIC EXCHANGE; PERIODIC DFT; REACTION PATHWAYS; SUPEROXIDES; SUPPORTED VANADIUM OXIDE CATALYST;

EID: 84873953626     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp311322b     Document Type: Article
Times cited : (15)

References (47)
  • 1
    • 0000114259 scopus 로고
    • The Reactivity of Oxide Surfaces
    • Winter, E. R. S. The Reactivity of Oxide Surfaces Adv. Catal. 1958, 10, 196-241
    • (1958) Adv. Catal. , vol.10 , pp. 196-241
    • Winter, E.R.S.1
  • 2
    • 0020298707 scopus 로고
    • Catalytic Activation of Dioxygen
    • 3 rd ed. Anderson, J. R. Bourdard, M. Springer-Verlag: New York
    • Boreskov, G. K. Catalytic Activation of Dioxygen. In Catalysis: Science and Technology, 3 rd ed.; Anderson, J. R.;. Bourdard, M., Eds.; Springer-Verlag: New York, 1982; pp 39-137.
    • (1982) Catalysis: Science and Technology , pp. 39-137
    • Boreskov, G.K.1
  • 3
    • 37049164653 scopus 로고
    • Exchange Reactions of Solid Oxides. Part V. Dissociation of Molecular Oxygen at Oxide Surfaces: Magnesium Oxide and Zinc Oxide
    • Winter, E. R. S. Exchange Reactions of Solid Oxides. Part V. Dissociation of Molecular Oxygen at Oxide Surfaces: Magnesium Oxide and Zinc Oxide J. Chem. Soc. 1954, 1522-1527
    • (1954) J. Chem. Soc. , pp. 1522-1527
    • Winter, E.R.S.1
  • 4
    • 37049044733 scopus 로고
    • Exchange Reactions of Solid Oxides. Part VII. Chronic Oxide, Nickel Oxide, and Ferric Oxide
    • Winter, E. R. S. Exchange Reactions of Solid Oxides. Part VII. Chronic Oxide, Nickel Oxide, and Ferric Oxide J. Chem. Soc. 1955, 3824-3834
    • (1955) J. Chem. Soc. , pp. 3824-3834
    • Winter, E.R.S.1
  • 5
    • 0015927880 scopus 로고
    • Investigation of Oxide-Type Oxidation Catalysts by Reactions of Oxygen Isotopic Exchange
    • Boreskov, G. K.; Muzykantov, V. S. Investigation of Oxide-Type Oxidation Catalysts by Reactions of Oxygen Isotopic Exchange Ann. N.Y. Acad. Sci. 1973, 213, 137-160
    • (1973) Ann. N.Y. Acad. Sci. , vol.213 , pp. 137-160
    • Boreskov, G.K.1    Muzykantov, V.S.2
  • 6
    • 0000398167 scopus 로고
    • Exchange Reactions of Oxygen between Oxygen Molecules and Solid Oxides
    • Klier, E.; Novakova, J.; Jiru, P. Exchange Reactions of Oxygen Between Oxygen Molecules and Solid Oxides J. Catal. 1963, 2, 479-484
    • (1963) J. Catal. , vol.2 , pp. 479-484
    • Klier, E.1    Novakova, J.2    Jiru, P.3
  • 7
    • 77956837208 scopus 로고
    • The Catalysis of Isotopic Exchange in Molecular Oxygen
    • Boreskov, G. K. The Catalysis of Isotopic Exchange in Molecular Oxygen Adv. Catal. 1964, 15, 285-339
    • (1964) Adv. Catal. , vol.15 , pp. 285-339
    • Boreskov, G.K.1
  • 8
    • 36749014302 scopus 로고
    • Exchange Reactions of Oxides
    • Winter, E. R. S. Exchange Reactions of Oxides J. Chem. Soc. A 1968, 2889-2902
    • (1968) J. Chem. Soc. A , pp. 2889-2902
    • Winter, E.R.S.1
  • 9
    • 0015198166 scopus 로고
    • 18O between the Gaseous Phase and Oxide Catalysts
    • 18O Between The Gaseous Phase and Oxide Catalysts Catal. Rev. 1970, 4, 77-114
    • (1970) Catal. Rev. , vol.4 , pp. 77-114
    • Novakova, J.1
  • 11
    • 57449093512 scopus 로고    scopus 로고
    • Hargreaves, J. S. J. Jackson, S. D. Webb, G. Imperial College Press: London
    • Hargreaves, J. S. J.; Mellor, I. M. In Isotopes in Heterogeneous Catalysis; Hargreaves, J. S. J.; Jackson, S. D.; Webb, G., Eds.; Imperial College Press: London, 2006; pp 115-132.
    • (2006) Isotopes in Heterogeneous Catalysis , pp. 115-132
    • Hargreaves, J.S.J.1    Mellor, I.M.2
  • 12
    • 0001029003 scopus 로고
    • Determination of the Types of Homo-Molecular Oxygen Exchange on Oxides
    • Muzykantov, V. S.; Panov, G. I.; Boreskov, G. K. Determination of the Types of Homo-Molecular Oxygen Exchange on Oxides Kinet. Katal. 1973, 14, 948-955
    • (1973) Kinet. Katal. , vol.14 , pp. 948-955
    • Muzykantov, V.S.1    Panov, G.I.2    Boreskov, G.K.3
  • 13
    • 34250218036 scopus 로고
    • Kinetics of Isotope Exchange in Molecular Oxygen - Solid Oxide System
    • Muzykantov, V. S.; Popovski, V. V.; Boreskov, G. K. Kinetics of Isotope Exchange in Molecular Oxygen-Solid Oxide System Kinet. Katal. 1964, 5, 624-629
    • (1964) Kinet. Katal. , vol.5 , pp. 624-629
    • Muzykantov, V.S.1    Popovski, V.V.2    Boreskov, G.K.3
  • 14
    • 80053096208 scopus 로고    scopus 로고
    • Hargreaves, J. S. J. Jackson, S. D. Webb, G. Imperial College Press: London
    • Duprez, D. In Isotopes in Heterogeneous Catalysis; Hargreaves, J. S. J.; Jackson, S. D.; Webb, G., Eds.; Imperial College Press: London, 2006; 133-181.
    • (2006) Isotopes in Heterogeneous Catalysis , pp. 133-181
    • Duprez, D.1
  • 16
    • 0001489502 scopus 로고    scopus 로고
    • The Oxygen Isotopic Exchange Reaction on Vanadium Oxide Catalysts
    • Doornkamp, C.; Clement, M.; Gao, X.; Deo, G.; Wachs, I. E.; Ponec, V. The Oxygen Isotopic Exchange Reaction on Vanadium Oxide Catalysts J. Catal. 1999, 185, 415-422
    • (1999) J. Catal. , vol.185 , pp. 415-422
    • Doornkamp, C.1    Clement, M.2    Gao, X.3    Deo, G.4    Wachs, I.E.5    Ponec, V.6
  • 17
    • 0001105992 scopus 로고    scopus 로고
    • Isotopic Tracer and Kinetic Studies of Oxidative Dehydrogenation Pathways on Vanadium Oxide Catalysts
    • Chen, K. D.; Khodakov, A.; Yang, J.; Bell, A. T.; Iglesia, E. Isotopic Tracer and Kinetic Studies of Oxidative Dehydrogenation Pathways on Vanadium Oxide Catalysts J. Catal. 1999, 186, 325
    • (1999) J. Catal. , vol.186 , pp. 325
    • Chen, K.D.1    Khodakov, A.2    Yang, J.3    Bell, A.T.4    Iglesia, E.5
  • 18
    • 0001469244 scopus 로고    scopus 로고
    • Kinetic Isotopic Effects in Oxidative Dehydrogenation of Propane on Vanadium Oxide Catalysts
    • Chen, K. D.; Iglesia, E.; Bell, A. T. Kinetic Isotopic Effects in Oxidative Dehydrogenation of Propane on Vanadium Oxide Catalysts J. Catal. 2000, 192, 197-203
    • (2000) J. Catal. , vol.192 , pp. 197-203
    • Chen, K.D.1    Iglesia, E.2    Bell, A.T.3
  • 19
    • 0035138419 scopus 로고    scopus 로고
    • Isotopic Tracer Studies of Reaction Pathways for Propane Oxidative Dehydrogenation on Molybdenum Oxide Catalysts
    • Chen, K. D.; Iglesia, E.; Bell, A. T. Isotopic Tracer Studies of Reaction Pathways for Propane Oxidative Dehydrogenation on Molybdenum Oxide Catalysts J. Phys. Chem. B 2001, 105, 646-653
    • (2001) J. Phys. Chem. B , vol.105 , pp. 646-653
    • Chen, K.D.1    Iglesia, E.2    Bell, A.T.3
  • 21
    • 34548172493 scopus 로고    scopus 로고
    • Oxidative Dehydrogenation of Ethane and Propane: How Far from Commercial Implementation?
    • Cavani, F.; Ballarini, N.; Cericola, A. Oxidative Dehydrogenation of Ethane and Propane: How Far from Commercial Implementation? Catal. Today 2007, 127, 113-131
    • (2007) Catal. Today , vol.127 , pp. 113-131
    • Cavani, F.1    Ballarini, N.2    Cericola, A.3
  • 23
    • 0036578276 scopus 로고    scopus 로고
    • Catalytic Oxidative Dehydrogenation of N-Butane
    • Madeira, L. M.; Portela, M. F. Catalytic Oxidative Dehydrogenation of N-Butane Catal. Rev. 2002, 44, 247-286
    • (2002) Catal. Rev. , vol.44 , pp. 247-286
    • Madeira, L.M.1    Portela, M.F.2
  • 27
    • 78650896348 scopus 로고    scopus 로고
    • The Generality of Surface Vanadium Oxide Phases in Mixed Oxide Catalysts
    • Wachs, I. E. The Generality of Surface Vanadium Oxide Phases in Mixed Oxide Catalysts Appl. Catal., A 2011, 391, 36-42
    • (2011) Appl. Catal., A , vol.391 , pp. 36-42
    • Wachs, I.E.1
  • 28
    • 64549130913 scopus 로고    scopus 로고
    • Supported Vanadium Oxide in Heterogeneous Catalysis: Elucidating the Structure-Activity Relationship with Spectroscopy
    • Muylaert, I.; Van Der Voort, P. Supported Vanadium Oxide in Heterogeneous Catalysis: Elucidating the Structure-Activity Relationship with Spectroscopy Phys. Chem. Chem. Phys. 2009, 11, 2826-2832
    • (2009) Phys. Chem. Chem. Phys. , vol.11 , pp. 2826-2832
    • Muylaert, I.1    Van Der Voort, P.2
  • 30
    • 2942726334 scopus 로고    scopus 로고
    • Periodic Density Functional Theory Studies of Vanadia-Titania Catalysts: Structure and Stability of the Oxidized Monolayer
    • Vittadini, A.; Selloni, A. Periodic Density Functional Theory Studies of Vanadia-Titania Catalysts: Structure and Stability of the Oxidized Monolayer J. Phys. Chem. B 2004, 108, 7337-7343
    • (2004) J. Phys. Chem. B , vol.108 , pp. 7337-7343
    • Vittadini, A.1    Selloni, A.2
  • 31
  • 35
    • 20544463457 scopus 로고
    • Soft Self-Consistent Pseudopotentials in a Generalized Eigenvalue Formalism
    • Vanderbilt, D. Soft Self-Consistent Pseudopotentials in a Generalized Eigenvalue Formalism Phys. Rev. B 1990, 41, 7892-7895
    • (1990) Phys. Rev. B , vol.41 , pp. 7892-7895
    • Vanderbilt, D.1
  • 36
    • 4243943295 scopus 로고    scopus 로고
    • Generalized Gradient Approximation Made Simple
    • Perdew, J. P.; Burke, K.; Ernzerhof, M. Generalized Gradient Approximation Made Simple Phys. Rev. Lett. 1996, 77, 3865-3868
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865-3868
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 37
    • 0034513054 scopus 로고    scopus 로고
    • Climbing Image Nudged Elastic Band Method for Finding Saddle Points and Minimum Energy Paths
    • Henkelman, G.; Uberuaga, B. P.; Jonsson, H. A. Climbing Image Nudged Elastic Band Method for Finding Saddle Points and Minimum Energy Paths J. Chem. Phys. 2000, 113, 9901-9904
    • (2000) J. Chem. Phys. , vol.113 , pp. 9901-9904
    • Henkelman, G.1    Uberuaga, B.P.2    Jonsson, H.A.3
  • 38
    • 1242329035 scopus 로고    scopus 로고
    • Improved Tangent Estimate in the Nudged Elastic Band Method for Finding Minimum Energy Paths and Saddle Points
    • Henkelman, G.; Jonsson, H. Improved Tangent Estimate in the Nudged Elastic Band Method for Finding Minimum Energy Paths and Saddle Points J. Chem. Phys. 2000, 113, 9978-9985
    • (2000) J. Chem. Phys. , vol.113 , pp. 9978-9985
    • Henkelman, G.1    Jonsson, H.2
  • 39
  • 40
    • 3442902425 scopus 로고
    • 2 Dissociative Adsorption - Evaluation of Free-Energy Barriers in Multidimensional Quantum-Systems
    • 2 Dissociative Adsorption-Evaluation of Free-Energy Barriers in Multidimensional Quantum-Systems Phys. Rev. Lett. 1994, 72, 1124-1127
    • (1994) Phys. Rev. Lett. , vol.72 , pp. 1124-1127
    • Mills, G.1    Jonsson, H.2
  • 41
    • 0029254909 scopus 로고
    • Reversible Work Transition-State Theory - Application to Dissociative Adsorption of Hydrogen
    • Mills, G.; Jonsson, H.; Schenter, G. K. Reversible Work Transition-State Theory-Application to Dissociative Adsorption of Hydrogen Surf. Sci. 1995, 324, 305-337
    • (1995) Surf. Sci. , vol.324 , pp. 305-337
    • Mills, G.1    Jonsson, H.2    Schenter, G.K.3
  • 42
    • 84873978683 scopus 로고    scopus 로고
    • accessed Jan 15, 2012
    • Chemcraft. http://www.chemcraftprog.com/ (accessed Jan 15, 2013).
    • Chemcraft
  • 43
    • 0141991888 scopus 로고    scopus 로고
    • Computer Graphics and Graphical User Interfaces as Tools in Simulations of Matter at the Atomic Scale
    • Kokalj, A. Computer Graphics and Graphical User Interfaces as Tools in Simulations of Matter at the Atomic Scale Comput. Mater. Sci. 2003, 28, 155-168
    • (2003) Comput. Mater. Sci. , vol.28 , pp. 155-168
    • Kokalj, A.1
  • 44
    • 0034724987 scopus 로고    scopus 로고
    • Solid State Aspects of Oxidation Catalysis
    • Gellings, P. J.; Bouwmeester, H. J. M. Solid State Aspects of Oxidation Catalysis Catal. Today 2000, 58, 1-53
    • (2000) Catal. Today , vol.58 , pp. 1-53
    • Gellings, P.J.1    Bouwmeester, H.J.M.2
  • 45
    • 33747859647 scopus 로고    scopus 로고
    • Active Oxygen in Selective Oxidation Catalysis
    • Panov, G. I.; Dubkov, K. A.; Starokon, E. V. Active Oxygen in Selective Oxidation Catalysis Catal. Today 2006, 117, 148-155
    • (2006) Catal. Today , vol.117 , pp. 148-155
    • Panov, G.I.1    Dubkov, K.A.2    Starokon, E.V.3
  • 46
    • 0346079807 scopus 로고
    • Characterization and Reactivity of Mononuclear Oxygen Species on Oxide Surfaces
    • Che, M.; Tench, A. J. Characterization and Reactivity of Mononuclear Oxygen Species on Oxide Surfaces Adv. Catal. 1982, 31, 77-133
    • (1982) Adv. Catal. , vol.31 , pp. 77-133
    • Che, M.1    Tench, A.J.2
  • 47
    • 35348869928 scopus 로고
    • Characterization and Reactivity of Molecular-Oxygen Species on Oxide Surfaces
    • Che, M.; Tench, A. J. Characterization and Reactivity of Molecular-Oxygen Species on Oxide Surfaces Adv. Catal. 1983, 32, 1-148
    • (1983) Adv. Catal. , vol.32 , pp. 1-148
    • Che, M.1    Tench, A.J.2


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