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Simulation Of A Multi-Component Transport Model For The Chemical Reaction Of A Cvd-Process

Simulation of a multi-component transport model for the chemical reaction of a CVD-process
Authors: Geiser, J.; Röhle, R.;

Simulation Of A Multi-Component Transport Model For The Chemical Reaction Of A Cvd-Process

Abstract

{"references": ["U.M. Ascher, St.J. Ruuth and R.J. Spiteri, Implicit-explicit Runge-Kutta\nmethods for time-dependent partial differential equations, Applied\nNumerical Mathematics, vol. 25, no. 2-3, 151-167, 1997.", "P. Buchner, A. Datz, K. Dennerlein, S. Lang and M. Waidhas. Low-cost\nair-cooled PEFC stacks. Journal of Power Sources, vol. 105, iss. 2, 243-\n249, 2002.", "J.C. Butcher. Numerical Methods for Ordinary Differential Equations.\nJohn Wiley & Sons Ltd, Chichester, 2003.", "D.J. Christie. Target material pathways model for high power pulsed\nmagnetron sputtering. J. Vac. Sci. Technol., A 23 (2), 330-335, 2005.", "P. Csom'os, I. Farag'o and A. Havasi. Weighted sequential splittings\nand their analysis. Comput. Math. Appl., (to appear)", "K.-J. Engel, R. Nagel, One-Parameter Semigroups for Linear Evolution\nEquations. Springer, New York, 2000.", "I. Farago, and Agnes Havasi. On the convergence and local splitting\nerror of different splitting schemes. E\u00f6tv\u00f6s Lorand University, Budapest,\n2004.", "I. Farago. Splitting methods for abstract Cauchy problems. Lect. Notes\nComp.Sci. 3401, Springer Verlag, Berlin, 2005, pp. 35-45", "I. Farago, J. Geiser. Iterative Operator-Splitting methods for Linear\nProblems. Preprint No. 1043 of theWeierstrass Institute for Applied\nAnalysis and Stochastics, Berlin, Germany, June 2005.\n[10] P. Frolkovi\u2566\u00e7c and H. De Schepper. Numerical modelling of convection\ndominated transport coupled with density driven flow in porous media.\nAdvances in Water Resources, 24:63-72, 2001.\n[11] J. Geiser. Numerical Simulation of a Model for Transport and Reaction\nof Radionuclides. Proceedings of the Large Scale Scientific\nComputations of Engineering and Environmental Problems, Sozopol,\nBulgaria, 2001.\n[12] J. Geiser. Gekoppelte Diskretisierungsverfahren f\u251c\u255dr Systeme von\nKonvektions- Dispersions-Diffusions-Reaktionsgleichungen. Doktor-\nArbeit, Universit\u252c\u00bfat Heidelberg, 2003.\n[13] J.Geiser.R3T: Radioactive-Retardation-Reaction-Transport-Program for\nthe Simulation of radioactive waste disposals. Proceedings: Computing,\nCommunications and Control Technologies: CCCT 2004, The\nUniversity of Texas at Austin and The International Institute of\nInformatics and Systemics (IIIS), to appear, 2004.\n[14] M.K. Gobbert and C.A. Ringhofer. An asymptotic analysis for a model\nof chemical vapor deposition on a microstructured surface. SIAM\nJournal on Applied Mathematics, 58, 737-752, 1998.\n[15] J. Jansen. Acceleration of waveform relaxation methods for linear\nordinary and partial differential equations PhD-thesis, Department of\nComputer Science, K.U.Leuven, Belgium, 1999.\n[16] D. Keffer, H.T. Davis and A.V. McCormick, The effect of nanopore\nshape on the structure and isotherms of adsorbed fluids, Springer\nNetherlands, Vol. 2, No. 1, 1996\n[17] R.J. Kaye and A.Sangiovanni-Vincentelli. Solution of piecewiese-linear\nordinary differential equations using waveform relaxation and laplace\ntransform. IEEE Transaction on systems, MAN, and Cybernetics, Vol.\nSMC-13, No. 4, 1983.\n[18] M.A. Lieberman and A.J. Lichtenberg. Principle of Plasma Discharges\nand Materials Processing. Wiley-Interscience, AA John Wiley & Sons,\nInc Publication, Second edition, 2005.\n[19] Chr. Lubich. A variational splitting integrator for quantum molecular\ndynamics. Report, 2003.\n[20] M. Ohring. Materials Science of Thin Films. Academic Press, San Diego,\nNew York, Boston, London, Second edition, 2002.\n[21] A.E. Scheidegger. General theory of dispersion in porous media. Journal\nof Geophysical Research, 66:32-73, 1961.\n[22] T.K. Senega and R.P. Brinkmann. A multi-component transport model\nfor nonequilibrium low-temperature low-pressure plasmas. J. Phys. D:\nAppl.Phys., 39, 1606-1618, 2006.\n[23] S. Vandewalle. Parallel Multigrid Waveform Relaxation for Parabolic\nProblems. B.G. Teubner, Stuttgart, 1993.\n[24] K.R. Westerterp, W.P.M. van Swaaij and A.A.C.M. Beenackers.\nChemical Reactor Design and Operation. John Wiley and Sons, New\nYork, Brisbane, Toronto, Singapore, 1984."]}

In this paper we present discretization and decomposition methods for a multi-component transport model of a chemical vapor deposition (CVD) process. CVD processes are used to manufacture deposition layers or bulk materials. In our transport model we simulate the deposition of thin layers. The microscopic model is based on the heavy particles, which are derived by approximately solving a linearized multicomponent Boltzmann equation. For the drift-process of the particles we propose diffusionreaction equations as well as for the effects of heat conduction. We concentrate on solving the diffusion-reaction equation with analytical and numerical methods. For the chemical processes, modelled with reaction equations, we propose decomposition methods and decouple the multi-component models to simpler systems of differential equations. In the numerical experiments we present the computational results of our proposed models.

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Keywords

convection-diffusion-reaction equations, decomposition methods, multi-component transport., Chemical kinetics in thermodynamics and heat transfer, chemical vapor deposition, Reaction-diffusion equations, Chemical reactions, Classical flows, reactions, etc. in chemistry, Stability and convergence of numerical methods for initial value and initial-boundary value problems involving PDEs

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