Artificial Boundary Conditions
When computing numerically the solution of a partial differential equation in an unbounded domain usually artificial boundaries are introduced to limit the computational domain. Special boundary conditions are derived at this artificial boundaries to approximate the exact whole-space solution. If the solution of the problem on the bounded domain is equal to the whole-space solution (restricted to the computational domain) these boundary conditions are called transparent boundary conditions (TBCs).
We are concerned with TBCs for general Schrödinger-type pseudo-differential equations arising from `parabolic' equation (PE) models which have been widely used for one-way wave propagation problems in various application areas, e.g. (underwater) acoustics, seismology, optics and plasma physics. As a special case the Schrödinger equation of quantum mechanics is included.
Existing discretizations of these TBCs induce numerical reflections at this artificial boundary and also may destroy the stability of the used finite difference method. These problems do not occur when using a so-called discrete TBC which is derived from the fully discretized whole-space problem. This discrete TBC is reflection-free and conserves the stability properties of the whole-space scheme. We point out that the superiority of discrete TBCs over other discretizations of TBCs is not restricted to the presented special types of partial differential equations or to our particular interior discretization scheme.
Another problem is the high numerical effort. Since the discrete TBC includes a convolution with respect to time with a weakly decaying kernel, its numerical evaluation becomes very costly for long-time simulations. As a remedy we construct new approximative TBCs involving exponential sums as an approximation to the convolution kernel. This special approximation enables us to use a fast evaluation of the convolution type boundary condition.
Finally, to illustrate the broad range of applicability of our approach we derived efficient discrete artificial boundary conditions for the Black-Scholes equation of American options.
Software
Our approach was implemented by C.A. Moyer in the QMTools software package for quantum mechanical applications.
Publications
- 2001
993.
G\"unther, Michael; Hoschek, M.; Weiner, R.
ROW methods adapted to a cheap Jacobian}
APNUM, 37 :231-240
2001992.
Günther, Michael; Hoschek, Markus
ROW-type Integration Methods for Circuit Simulation Packages
:448-455
2001
Herausgeber: B.G. Teubner, Stuttgart991.
Hecht, Dirk; Günther, Michael; Rienen, Ursula
Scientific Computing in Electrical Engineering: Proceedings
Herausgeber: Springer
2001990.
Scientific Computing in Electrical Engineering: Proceedings of the 3rd International Workshop, 20-23 August 2000, Warnemünde, Germany
In Rienen, Ursula and Günther, Michael and Hecht, Dirk, Editor aus Lecture Notes in Computational Science and Engineering
Herausgeber: Springer Berlin Heidelberg
2001ISBN: 978-3-540-42173-3
989.
Van Rienen, Ursula; Günther, Michael; Hecht, Dirk
Scientific Computing in Electrical Engineering: Proceedings of the 3rd International Workshop, August 20--23, 2000, Warnemünde, Germany
2001988.
Rienen, Ursula van; Günther, Michael; Hecht, Dirk
Scientific computing in electrical engineering: proceedings of the 3rd International Workshop, August 20-23, 2000, Warnemünde, Germany
(No Title)
2001987.
Scientific Computing in Electrical Engineering. Proceedings of the 3rd International Workshop, 20-23 August 2000, Warnem\"unde, Germany
In {van Rienen}, U. and G\"unther, M. and Hecht, D., Editor aus Lecture Notes in Computational Science and Engineering
Herausgeber: Springer-Verlag, Berlin
2001986.
Tausch, Michael W.
Sclüsselexperimente - Kreuzungen, Brücken und Pässe im Chemieunterricht
Praxis der Naturwissenschaften - Chemie in der Schule, 50 (3) :1
2001985.
McKeachie, J. Ryan; Veer, Wytze E.; Short, Luke Chandler; Garnica, R. M.; Appel, Matthew F.; Benter, Thorsten
Selective ultra-trace detection of NO and NO\(_{2}\) in complex gas mixtures using broad-bandwidth REMPI mass spectrometry
Analyst, 126 (8) :1221-1228
2001984.
McKeachie, J. Ryan; Veer, Wytze E.; Short, Luke Chandler; Garnica, R. M.; Appel, Matthew F.; Benter, Thorsten
Selective ultra-trace detection of NO and NO\(_{2}\) in complex gas mixtures using broad-bandwidth REMPI mass spectrometry
Analyst, 126 (8) :1221-1228
2001983.
McKeachie, J. Ryan; van der Veer, Wytze E.; Short, Luke Chandler; Garnica, R. M.; Appel, Matthew F.; Benter, Thorsten
Selective ultra-trace detection of NO and NO2 in complex gas mixtures using broad-bandwidth REMPI mass spectrometry
Analyst, 126 (8) :1221-1228
2001982.
Bach, Thorsten; Kirsch, Stefan
Synthesis of 6-Substituted 4-Hydroxy-2-pyrones from Aldehydes by Addition of an Acetoacetate Equivalent, Dess-Martin Oxidation and Subsequent Cyclization
Synlett, 2001 (12) :1974–1976
2001
ISSN: 0936-5214, 1437-2096981.
Jacob, Birgit; Partington, Jonathan R.
The Weiss conjecture on admissibility of observation operators for contraction semigroups
Integral Equations Operator Theory, 40 (2) :231--243
2001980.
Bartel, Andreas; Günther, Michael
The developments in multirating for coupled systems
ZAMM-Zeitschrift fur Angewandte Mathematik und Mechanik, 81 (S3) :739–742
2001979.
Bartel, A.; G\"unther, Michael
The developments in multirating for coupled systems
Z. f. Angew. Math. u. Mech., 81 (3) :S739--S742
2001978.
Yurchenko, Sergey N.; Jensen, Per; Li, Yan; Buenker, Robert J.; Bunker, Philip R.
The near ultraviolet band system of singlet methylene
Journal of Molecular Spectroscopy, 208 (1) :136-143
2001977.
Yurchenko, Sergey N.; Jensen, Per; Li, Yan; Buenker, Robert J.; Bunker, Philip R.
The near ultraviolet band system of singlet methylene
Journal of Molecular Spectroscopy, 208 (1) :136-143
2001976.
Yurchenko, Sergey N.; Jensen, Per; Li, Yan; Buenker, Robert J.; Bunker, Philip R.
The near ultraviolet band system of singlet methylene
Journal of Molecular Spectroscopy, 208 (1) :136-143
2001975.
Tausch, Michael W.; Wachtendonk, M.
UNTERRICHTSPRAXIS S II, Band 1 ''Protolysegleichgewichte''
Herausgeber: Aulis Verlag Deubner, Köln
2001974.
Tausch, Michael W.; Woock, M.; Twellmann, M.
Vom Erdöl zum Kaugummi - ein Kontext und seine Facetten
Praxis der Naturwissenschaften - Chemie in der Schule, 50 (1) :11
2001973.
[german] Bohrmann, Claudia; Twellmann, M.; Tausch, Michael W.
Vom galvanischen Element zur Solarzelle
Naturwissenschaften im Unterricht Chemie, 66 (6) :12–16
2001972.
Jacob, Birgit
Zeros of Fredholm operator valued H^p-functions
Math. Nachr., 227 :81--97
2001- 2000
971.
Günther, Michael
A joint DAE/PDE model for interconnected electrical networks
Mathematical and Computer Modelling of Dynamical Systems, 6 :114–128
2000
Herausgeber: Taylor & Francis970.
A joint DAE/PDE model for interconnected electrical networks
Mathematical and Computer Modelling of Dynamical Systems, 6 (2) :114--128
2000
Herausgeber: Taylor \& Francis969.
Garnica, R. M.; Appel, Matthew F.; Eagan, L.; McKeachie, J. Ryan; Benter, Thorsten
A REMPI method for the ultrasensitive detection of NO and NO\(_{2}\) using atmospheric pressure laser ionization mass spectrometry
Analytical Chemistry, 72 (22) :5639-5646
2000