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Volumn 64, Issue 7, 2009, Pages 1384-1389

Efficient implementation of detailed surface chemistry into reactor models using mapped rate data

Author keywords

Catalysis; Kinetics; Mapping; Mathematical modeling; Monolith; Simulation

Indexed keywords

CAPILLARITY; CATALYSIS; CONFORMAL MAPPING; MONOLITHIC INTEGRATED CIRCUITS; PLATINUM; SURFACE CHEMISTRY; SURFACE REACTIONS; THREE DIMENSIONAL;

EID: 60549114075     PISSN: 00092509     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ces.2008.12.006     Document Type: Article
Times cited : (47)

References (27)
  • 1
    • 0032053937 scopus 로고    scopus 로고
    • Modelling the temporal evolution of a reduced combustion chemical system with an artificial neural network
    • Blasco J.A., Fueyo N., Dopazo C., and Ballester J. Modelling the temporal evolution of a reduced combustion chemical system with an artificial neural network. Combustion and Flame 113 (1998) 38-52
    • (1998) Combustion and Flame , vol.113 , pp. 38-52
    • Blasco, J.A.1    Fueyo, N.2    Dopazo, C.3    Ballester, J.4
  • 3
    • 0030250018 scopus 로고    scopus 로고
    • Artificial neural network implementation of chemistry with pdf simulation of H-2/CO2 flames
    • Christo F.C., Masri A.R., and Nebot E.M. Artificial neural network implementation of chemistry with pdf simulation of H-2/CO2 flames. Combustion and Flame 106 (1996) 406-427
    • (1996) Combustion and Flame , vol.106 , pp. 406-427
    • Christo, F.C.1    Masri, A.R.2    Nebot, E.M.3
  • 5
    • 34248403165 scopus 로고    scopus 로고
    • A reduced mechanism for methane and one-step rate expressions for fuel-lean catalytic combustion of small alkanes on noble metals
    • Deshmukh S.R., and Vlachos D.G. A reduced mechanism for methane and one-step rate expressions for fuel-lean catalytic combustion of small alkanes on noble metals. Combustion and Flame 149 (2007) 366-383
    • (2007) Combustion and Flame , vol.149 , pp. 366-383
    • Deshmukh, S.R.1    Vlachos, D.G.2
  • 6
    • 60549114029 scopus 로고    scopus 로고
    • Computational Fluid Dynamics Simulation of Catalytic Reactors
    • Ertl, G, Knözinger, H, Schüth, F, Weitkamp, J, Eds, second ed, Wiley-VCH, pp
    • Deutschmann, O., 2008. Computational Fluid Dynamics Simulation of Catalytic Reactors. In: Ertl, G., Knözinger, H., Schüth, F., Weitkamp, J., (Eds.), Handbook of Heterogeneous Catalysis, second ed., Wiley-VCH, pp. 1811-1821.
    • (2008) Handbook of Heterogeneous Catalysis , pp. 1811-1821
    • Deutschmann, O.1
  • 8
    • 0022554253 scopus 로고
    • The reduction and parameterization of chemical mechanisms for inclusion in atmospheric reaction-transport models
    • Dunker A.M. The reduction and parameterization of chemical mechanisms for inclusion in atmospheric reaction-transport models. Atmospheric Environment 20 (1986) 479-486
    • (1986) Atmospheric Environment , vol.20 , pp. 479-486
    • Dunker, A.M.1
  • 9
    • 15544380494 scopus 로고    scopus 로고
    • An open-source, extensible software suite for CVD process simulation
    • Allendorf, M, Maury, F, Teyssandier, F, Eds, The Electrochemical Society, pp
    • Goodwin, D.G., 2003. An open-source, extensible software suite for CVD process simulation. In: Allendorf, M., Maury, F., Teyssandier, F. (Eds.), Chemical Vapor Deposition XVI and EUROCVD 14, ECS Proceedings Volume 2003-08, The Electrochemical Society, pp. 155-162.
    • (2003) Chemical Vapor Deposition XVI and EUROCVD 14, ECS Proceedings , vol.2003 -08 , pp. 155-162
    • Goodwin, D.G.1
  • 10
    • 3042801849 scopus 로고    scopus 로고
    • The effect of washcoat geometry on mass transfer in monolith reactors
    • Hayes R.E., Liu B., Moxom R., and Votsmeier M. The effect of washcoat geometry on mass transfer in monolith reactors. Chemical Engineering Science 59 (2004) 3169-3181
    • (2004) Chemical Engineering Science , vol.59 , pp. 3169-3181
    • Hayes, R.E.1    Liu, B.2    Moxom, R.3    Votsmeier, M.4
  • 11
    • 13844264283 scopus 로고    scopus 로고
    • Calculating effectiveness factors in non-uniform washcoat shapes
    • Hayes R.E., Liu B., and Votsmeier M. Calculating effectiveness factors in non-uniform washcoat shapes. Chemical Engineering Science 60 (2005) 2037-2050
    • (2005) Chemical Engineering Science , vol.60 , pp. 2037-2050
    • Hayes, R.E.1    Liu, B.2    Votsmeier, M.3
  • 12
    • 0031119776 scopus 로고    scopus 로고
    • An efficient storage scheme for reduced chemical kinetics based on orthogonal polynomials
    • Hiemann H., Schmidt D., and Maas U. An efficient storage scheme for reduced chemical kinetics based on orthogonal polynomials. Journal of Engineering Mathematics 31 (1997) 131-141
    • (1997) Journal of Engineering Mathematics , vol.31 , pp. 131-141
    • Hiemann, H.1    Schmidt, D.2    Maas, U.3
  • 13
    • 0026833045 scopus 로고
    • Simplifying chemical kinetics: intrinsic low-dimensional manifolds in composition space
    • Maas U., and Pope S.B. Simplifying chemical kinetics: intrinsic low-dimensional manifolds in composition space. Combustion and Flame 88 (1992) 239
    • (1992) Combustion and Flame , vol.88 , pp. 239
    • Maas, U.1    Pope, S.B.2
  • 14
    • 0002714721 scopus 로고
    • Implementation of simplified chemical Kinetics based on intrinsic low-dimensional manifolds
    • Maas, U., Pope, S.B., 1992b. Implementation of simplified chemical Kinetics based on intrinsic low-dimensional manifolds. In: Twenty-Fourth Symposium (International) on Combustion, p. 369.
    • (1992) Twenty-Fourth Symposium (International) on Combustion , pp. 369
    • Maas, U.1    Pope, S.B.2
  • 15
    • 0023324486 scopus 로고
    • Increasing the computational feasibility of urban air quality models that employ complex chemical mechanisms
    • Marsden Jr. A.R., Frenklach M., and Reible D.D. Increasing the computational feasibility of urban air quality models that employ complex chemical mechanisms. Journal of the Air Pollution Control Association 37 (1987) 370-376
    • (1987) Journal of the Air Pollution Control Association , vol.37 , pp. 370-376
    • Marsden Jr., A.R.1    Frenklach, M.2    Reible, D.D.3
  • 17
    • 0141900705 scopus 로고    scopus 로고
    • Computationally efficient implementation of combustion chemistry using in situ adaptive tabulation
    • Pope S.B. Computationally efficient implementation of combustion chemistry using in situ adaptive tabulation. Combustion Theory and Modelling 1 (1997) 41-63
    • (1997) Combustion Theory and Modelling , vol.1 , pp. 41-63
    • Pope, S.B.1
  • 18
    • 0038300764 scopus 로고    scopus 로고
    • Experimental and numerical investigation of the ignition of methane combustion in a platinum-coated honeycomb monolith
    • Schwiedernoch R., Tischer S., Deutschmann O., and Warnatz J. Experimental and numerical investigation of the ignition of methane combustion in a platinum-coated honeycomb monolith. Proceedings of the Combustion Institute 29 (2002) 1005-1011
    • (2002) Proceedings of the Combustion Institute , vol.29 , pp. 1005-1011
    • Schwiedernoch, R.1    Tischer, S.2    Deutschmann, O.3    Warnatz, J.4
  • 19
    • 2942635772 scopus 로고    scopus 로고
    • Efficient chemical kinetic modeling through neural network maps
    • Shenvi N., Geremia J.M., and Rabitz H. Efficient chemical kinetic modeling through neural network maps. Journal of Chemical Physics 120 (2004) 9942-9951
    • (2004) Journal of Chemical Physics , vol.120 , pp. 9942-9951
    • Shenvi, N.1    Geremia, J.M.2    Rabitz, H.3
  • 20
    • 0001401996 scopus 로고    scopus 로고
    • An efficient chemical kinetics solver using high dimensional model representation
    • Shorter J.A., Ip P.C., and Rabitz H.A. An efficient chemical kinetics solver using high dimensional model representation. Journal of Physical Chemistry 103 (1999) 7192-7198
    • (1999) Journal of Physical Chemistry , vol.103 , pp. 7192-7198
    • Shorter, J.A.1    Ip, P.C.2    Rabitz, H.A.3
  • 21
    • 0025662423 scopus 로고
    • A numerical method for parameterization of atmospheric chemistry: computation of tropospheric OH
    • Spivakovsky C.M., Wofsy S.C., and Prather M.J. A numerical method for parameterization of atmospheric chemistry: computation of tropospheric OH. Journal of Geophysical Research 95 (1990) 433-439
    • (1990) Journal of Geophysical Research , vol.95 , pp. 433-439
    • Spivakovsky, C.M.1    Wofsy, S.C.2    Prather, M.J.3
  • 23
    • 0033450152 scopus 로고    scopus 로고
    • PRISM: piecewise reusable implementation of solution mapping. An economical strategy for chemical kinetics
    • Tonse S.R., Moriarty N.W., Brown N.J., and Frenklach M. PRISM: piecewise reusable implementation of solution mapping. An economical strategy for chemical kinetics. Israel Journal of Chemistry 39 (1999) 97-106
    • (1999) Israel Journal of Chemistry , vol.39 , pp. 97-106
    • Tonse, S.R.1    Moriarty, N.W.2    Brown, N.J.3    Frenklach, M.4
  • 24
    • 0001812977 scopus 로고
    • Parameterization of reaction mechanisms using orthonormal polynomials
    • Turanyi T. Parameterization of reaction mechanisms using orthonormal polynomials. Computers & Chemistry 18 (1994) 45-54
    • (1994) Computers & Chemistry , vol.18 , pp. 45-54
    • Turanyi, T.1
  • 25
    • 58149207824 scopus 로고
    • Application of repro-modelling for the reduction of combustion mechanisms
    • Turanyi T. Application of repro-modelling for the reduction of combustion mechanisms. Proceedings of the Combustion Institute 25 (1995) 949-955
    • (1995) Proceedings of the Combustion Institute , vol.25 , pp. 949-955
    • Turanyi, T.1
  • 26
    • 84915766800 scopus 로고    scopus 로고
    • Intrinsic low-dimensional manifolds of heterogeneous combustion processes
    • Yan X., and Maas U. Intrinsic low-dimensional manifolds of heterogeneous combustion processes. Proceedings of the Combustion Institute 28 (2000) 1615-1621
    • (2000) Proceedings of the Combustion Institute , vol.28 , pp. 1615-1621
    • Yan, X.1    Maas, U.2
  • 27
    • 2442698650 scopus 로고    scopus 로고
    • A new technique to measure the effective diffusivity in a catalytic monolith washcoat
    • Zhang F., Hayes R.E., and Kolaczkowski S.T. A new technique to measure the effective diffusivity in a catalytic monolith washcoat. Chemical Engineering Research and Design 82 A4 (2004) 481-489
    • (2004) Chemical Engineering Research and Design , vol.82 , Issue.A4 , pp. 481-489
    • Zhang, F.1    Hayes, R.E.2    Kolaczkowski, S.T.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.