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Journals and Conferences
This article presents a new complex absorbing potential (CAP) block Lanczos method for computing scattering eigenfunctions and reaction probabilities. The method reduces the problem of computing energy eigenfunctions to solving two energy dependent systems of equations. An energy independent block Lanczos factorization casts the system into a block… (More)
This article presents a new approach to long time wave packet propagation. The methodology relies on energy domain calculations and an on-the-surface straightforward energy to time transformation to provide wave packet time evolution. The adaptive bisection fast Fourier transform method employs selective bisection to create a multiresolution energy grid,… (More)