@article{Bauke2009CanonicalTA, title={Canonical transforms and the efficient integration of quantum mechanical wave equations.}, author={Heiko Bauke and Christoph H. Keitel}, journal={Physical review. E, Statistical, nonlinear, and soft matter physics}, year={2009}, volume={80 1 Pt 2}, pages={016706} }

- Published 2009 in Physical review. E, Statistical, nonlinear, and…

The integration of time-dependent quantum mechanical wave equations is a fundamental problem in computational physics and computational chemistry. The wave-function's energy spectrum as well as its momentum spectrum impose fundamental limits on the performance of numerical algorithms for the solution of wave equations. We demonstrate how canonical… CONTINUE READING

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