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Published online on July 24, 2002, 10.1073/pnas.112329799
PNAS | August 6, 2002 | vol. 99 | no. 16 | 10246-10251


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Applied Mathematics
Numerical operator calculus in higher dimensions

Gregory Beylkin *, and Martin J. Mohlenkamp

Applied Mathematics, University of Colorado, Boulder, CO 80309

Communicated by Ronald R. Coifman, Yale University, New Haven, CT and approved May 31, 2002 (received for review July 31, 2001)

When an algorithm in dimension one is extended to dimension d, in nearly every case its computational cost is taken to the power d. This fundamental difficulty is the single greatest impediment to solving many important problems and has been dubbed the curse of dimensionality. For numerical analysis in dimension d, we propose to use a representation for vectors and matrices that generalizes separation of variables while allowing controlled accuracy. Basic linear algebra operations can be performed in this representation using one-dimensional operations, thus bypassing the exponential scaling with respect to the dimension. Although not all operators and algorithms may be compatible with this representation, we believe that many of the most important ones are. We prove that the multiparticle Schrödinger operator, as well as the inverse Laplacian, can be represented very efficiently in this form. We give numerical evidence to support the conjecture that eigenfunctions inherit this property by computing the ground-state eigenfunction for a simplified Schrödinger operator with 30 particles. We conjecture and provide numerical evidence that functions of operators inherit this property, in which case numerical operator calculus in higher dimensions becomes feasible.

Abbreviations: SVD, singular value decomposition


* To whom reprint requests should be addressed. E-mail: beylkin{at}colorado.edu.

This paper was submitted directly (Track II) to the PNAS office.


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