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Volumn 39, Issue 5, 2008, Pages 467-473

Graph-theoretic and energetic exploration of catalytic pathways of the water-gas shift reaction

Author keywords

Catalytic reaction; Graph theoretic; Identification; Pathway; Water gas

Indexed keywords

CATALYSIS; CATALYST ACTIVITY; CHEMICAL SHIFT; GRAPH THEORY; HYDROGEN PRODUCTION; IDENTIFICATION (CONTROL SYSTEMS);

EID: 56949102768     PISSN: 03681653     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jcice.2008.04.004     Document Type: Article
Times cited : (14)

References (33)
  • 1
    • 0001376298 scopus 로고    scopus 로고
    • A Note on Connection between PNS and Set Covering Problems
    • Blázsik, Z. and B. Imreh, "A Note on Connection between PNS and Set Covering Problems," Acta Cyber, 12, 309 (1996).
    • (1996) Acta Cyber , vol.12 , pp. 309
    • Blázsik, Z.1    Imreh, B.2
  • 2
    • 0032518895 scopus 로고    scopus 로고
    • Studies of the Water-Gas-Shift Reaction on Ceria-Supported Pt, Pd, and Rh: Implications for Oxygen-Storage Properties
    • Bunluesin, T., R. J. Gorte, and G. W. Graham, "Studies of the Water-Gas-Shift Reaction on Ceria-Supported Pt, Pd, and Rh: Implications for Oxygen-Storage Properties," Appl. Catal. B, 15, 107 (1998).
    • (1998) Appl. Catal. B , vol.15 , pp. 107
    • Bunluesin, T.1    Gorte, R.J.2    Graham, G.W.3
  • 4
    • 0042882143 scopus 로고    scopus 로고
    • In situ Infrared Study of Oxidative Carbonylation of Aniline with Methanol on Cu-Based Catalysts
    • Chen, B. and S. S. C. Chuang, "In situ Infrared Study of Oxidative Carbonylation of Aniline with Methanol on Cu-Based Catalysts," Green Chem., 5, 484 (2003).
    • (2003) Green Chem , vol.5 , pp. 484
    • Chen, B.1    Chuang, S.S.C.2
  • 6
    • 0035189909 scopus 로고    scopus 로고
    • Mechanisms of Ammonia-Synthesis Reaction Revisited with the Aid of a Novel Graph-Theoretic Method for Determining Candidate Mechanisms in Deriving the Rate Law of a Catalytic Reaction
    • Fan, L. T., B. Bertók, F. Friedler, and S. Shafie, "Mechanisms of Ammonia-Synthesis Reaction Revisited with the Aid of a Novel Graph-Theoretic Method for Determining Candidate Mechanisms in Deriving the Rate Law of a Catalytic Reaction," Hung. J. Ind. Chem., 29, 71 (2001).
    • (2001) Hung. J. Ind. Chem , vol.29 , pp. 71
    • Fan, L.T.1    Bertók, B.2    Friedler, F.3    Shafie, S.4
  • 7
    • 0036007080 scopus 로고    scopus 로고
    • A Graph-Tbeoretic Method to Identify Candidate Mechanisms for Deriving the Rate Law of a Catalytic Reaction
    • Fan, L. T., B. Bertók, and F. Friedler, "A Graph-Tbeoretic Method to Identify Candidate Mechanisms for Deriving the Rate Law of a Catalytic Reaction," Comput. Chem., 26, 265 (2002).
    • (2002) Comput. Chem , vol.26 , pp. 265
    • Fan, L.T.1    Bertók, B.2    Friedler, F.3
  • 9
    • 0035972398 scopus 로고    scopus 로고
    • De Donder Relations in Mechanistic and Kinetic Analysis of Heterogeneous Catalytic Reactions
    • Fishtik, I. and R. Datta, "De Donder Relations in Mechanistic and Kinetic Analysis of Heterogeneous Catalytic Reactions," Ind. Eng. Chem. Res., 40, 2416 (2001).
    • (2001) Ind. Eng. Chem. Res , vol.40 , pp. 2416
    • Fishtik, I.1    Datta, R.2
  • 10
    • 0036643591 scopus 로고    scopus 로고
    • Fishtik, I. and R. Datta, A UBI-QEP Microkinetic Model for the Water-Gas Shift Reaction on Cu(1 1 1), Surf. Sci., 512, 229 (2002).
    • Fishtik, I. and R. Datta, "A UBI-QEP Microkinetic Model for the Water-Gas Shift Reaction on Cu(1 1 1)," Surf. Sci., 512, 229 (2002).
  • 11
    • 0026883134 scopus 로고
    • Graph-Theoretic Approach to Process Synthesis - Axioms and Theorems
    • Friedler, F., K. Tarjan, Y. W. Huang, and L. T. Fan, "Graph-Theoretic Approach to Process Synthesis - Axioms and Theorems," Chem. Eng. Sci., 47, 1973 (1992).
    • (1992) Chem. Eng. Sci , vol.47 , pp. 1973
    • Friedler, F.1    Tarjan, K.2    Huang, Y.W.3    Fan, L.T.4
  • 12
    • 0027657389 scopus 로고
    • Graph-Theoretic Approach to Process Synthesis - Polynomial Algorithm for Maximal Structure Generation
    • Friedler, F., K. Tarjan, Y. W. Huang, and L. T. Fan, "Graph-Theoretic Approach to Process Synthesis - Polynomial Algorithm for Maximal Structure Generation," Comput. Chem. Eng., 17, 929 (1993).
    • (1993) Comput. Chem. Eng , vol.17 , pp. 929
    • Friedler, F.1    Tarjan, K.2    Huang, Y.W.3    Fan, L.T.4
  • 13
    • 0029323905 scopus 로고
    • Decision-Mapping - A Tool for Consistent and Complete Decisions In-Process Synthesis
    • Friedler, F., J. B. Varga, and L. T. Fan, "Decision-Mapping - A Tool for Consistent and Complete Decisions In-Process Synthesis," Chem. Eng. Sci., 50, 1755 (1995).
    • (1995) Chem. Eng. Sci , vol.50 , pp. 1755
    • Friedler, F.1    Varga, J.B.2    Fan, L.T.3
  • 15
    • 0037160330 scopus 로고    scopus 로고
    • Systematic Waste Minimization in Chemical Processes. 1. Methodology
    • Halim, I. and R. Srinivasan, "Systematic Waste Minimization in Chemical Processes. 1. Methodology," Ind. Eng. Chem. Res., 41, 196 (2002a).
    • (2002) Ind. Eng. Chem. Res , vol.41 , pp. 196
    • Halim, I.1    Srinivasan, R.2
  • 16
    • 0037160330 scopus 로고    scopus 로고
    • Systematic Waste Minimization in Chemical Processes. 2. Decision Support System
    • Halim, I. and R. Srinivasan, "Systematic Waste Minimization in Chemical Processes. 2. Decision Support System," Ind Eng. Chem. Res., 41, 208 (2002b).
    • (2002) Ind Eng. Chem. Res , vol.41 , pp. 208
    • Halim, I.1    Srinivasan, R.2
  • 17
    • 0034958350 scopus 로고    scopus 로고
    • A New Well-Solved Class of PNS Problems
    • Imreh, Cs, "A New Well-Solved Class of PNS Problems," Computing, 66,289 (2001).
    • (2001) Computing , vol.66 , pp. 289
    • Imreh, C.1
  • 18
    • 18844409184 scopus 로고    scopus 로고
    • Complementary Identification of Multiple Flux Distributions and Multiple Metabolic Pathways
    • Lee, D. Y., L. T. Fan, S. Park, S. Y. Lee, S. Shafie, B. Bertók, and F. Friedler, "Complementary Identification of Multiple Flux Distributions and Multiple Metabolic Pathways," Metab. Eng., 7, 182 (2005).
    • (2005) Metab. Eng , vol.7 , pp. 182
    • Lee, D.Y.1    Fan, L.T.2    Park, S.3    Lee, S.Y.4    Shafie, S.5    Bertók, B.6    Friedler, F.7
  • 19
    • 0034617635 scopus 로고    scopus 로고
    • Low-Temperature Water-Gas Shift Reaction over Cu- and Ni-Loaded Cerium Oxide Catalysts
    • Li, Y., Q. Fu, and M. Flytzani-Stephanopoulos, "Low-Temperature Water-Gas Shift Reaction over Cu- and Ni-Loaded Cerium Oxide Catalysts," Appl. Catal. B, 27, 179 (2000).
    • (2000) Appl. Catal. B , vol.27 , pp. 179
    • Li, Y.1    Fu, Q.2    Flytzani-Stephanopoulos, M.3
  • 21
    • 0000519102 scopus 로고
    • Symbolic and Quantitative Reasoning: Design of Reaction Pathways through Recursive Satisfaction of Constraints
    • Mavrovouniotis, M. L., "Symbolic and Quantitative Reasoning: Design of Reaction Pathways through Recursive Satisfaction of Constraints," Adv. Chem. Eng., 21, 147 (1995).
    • (1995) Adv. Chem. Eng , vol.21 , pp. 147
    • Mavrovouniotis, M.L.1
  • 22
    • 33748643606 scopus 로고    scopus 로고
    • Nakamura, J., J. M. Campbell, and C. T. Campbell, Kinetics and Mechanism of the Water-Gas Shift Reaction Catalyzed by the Clean and Cs-Promoted Cu (1 10) Surface - A Comparison with Cu (1 1 1), J. Chem. Soc., Faraday Trans., 86, 2725 (1990).
    • Nakamura, J., J. M. Campbell, and C. T. Campbell, "Kinetics and Mechanism of the Water-Gas Shift Reaction Catalyzed by the Clean and Cs-Promoted Cu (1 10) Surface - A Comparison with Cu (1 1 1)," J. Chem. Soc., Faraday Trans., 86, 2725 (1990).
  • 23
    • 0019172711 scopus 로고
    • The Water-Gas Shift Reaction
    • Newsome, D. S., "The Water-Gas Shift Reaction," Catal. Rev.-Sci. Eng., 21, 275 (1980).
    • (1980) Catal. Rev.-Sci. Eng , vol.21 , pp. 275
    • Newsome, D.S.1
  • 24
    • 5444249962 scopus 로고    scopus 로고
    • Combinatorial Analysis Application for Flowsheet Synthesis of Chemical Plants
    • Partin, L. R., "Combinatorial Analysis Application for Flowsheet Synthesis of Chemical Plants," Maple Tech., 5, 15 (1998).
    • (1998) Maple Tech , vol.5 , pp. 15
    • Partin, L.R.1
  • 25
    • 0002410724 scopus 로고
    • Water-Gas Shift Reaction: Finding the Mechanistic Boundary
    • Rhodes, C., G. J. Hutchings, and A. M. Ward, "Water-Gas Shift Reaction: Finding the Mechanistic Boundary," Catal. Today, 23, 43 (1995).
    • (1995) Catal. Today , vol.23 , pp. 43
    • Rhodes, C.1    Hutchings, G.J.2    Ward, A.M.3
  • 28
    • 0001469573 scopus 로고
    • 2, in Relation to Reactant-Promoted Mechanism
    • 2, in Relation to Reactant-Promoted Mechanism," J. Catal., 136, 493 (1992).
    • (1992) J. Catal , vol.136 , pp. 493
    • Shido, T.1    Iwasawa, Y.2
  • 30
    • 0031704584 scopus 로고    scopus 로고
    • The UBI-QEP Method: A Practical Theoretical Approach to Understanding Chemistry on Transition Metal Surfaces
    • Shustorovich, E. and H. Sellers, "The UBI-QEP Method: A Practical Theoretical Approach to Understanding Chemistry on Transition Metal Surfaces," Surf. Sci. Rep., 31, 5 (1998).
    • (1998) Surf. Sci. Rep , vol.31 , pp. 5
    • Shustorovich, E.1    Sellers, H.2
  • 31
    • 33747065298 scopus 로고    scopus 로고
    • On the Mechanism of Methanol Synthesis and the Water-Gas Shift Reaction on ZnO
    • Tabatabaei, J., B. H. Sakakini, and K. C. Waugh, "On the Mechanism of Methanol Synthesis and the Water-Gas Shift Reaction on ZnO," Catal. Lett., 110, 77 (2006).
    • (2006) Catal. Lett , vol.110 , pp. 77
    • Tabatabaei, J.1    Sakakini, B.H.2    Waugh, K.C.3
  • 32
    • 0033613479 scopus 로고    scopus 로고
    • Prediction of Global Reaction Kinetics by Solution of the Arrhenius Parameterised Component Elementary Reactions: Microkinetic Analysis
    • Waugh, K. C., "Prediction of Global Reaction Kinetics by Solution of the Arrhenius Parameterised Component Elementary Reactions: Microkinetic Analysis," Catal. Today, 53, 161 (1999).
    • (1999) Catal. Today , vol.53 , pp. 161
    • Waugh, K.C.1
  • 33
    • 0037148132 scopus 로고    scopus 로고
    • Snapshots of A Working Catalyst: Possibilities and Limitations of in situ Spectroscopy in the Field of Heterogeneous Catalysis
    • Weckhuysen, B. M., "Snapshots of A Working Catalyst: Possibilities and Limitations of in situ Spectroscopy in the Field of Heterogeneous Catalysis," Chem. Commun., 97 (2002).
    • (2002) Chem. Commun , vol.97
    • Weckhuysen, B.M.1


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