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David Strubbe edited figures/nfft_discretization1/caption.tex
over 9 years ago
Commit id: 082baae5733a70c8d190916113111d2795b2ac8d
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...
space partitions corresponding to Fig.~\ref{fig:pes_sheme}.
Owing to the discretization of the Fourier integrals, periodic conditions are imposed at the boundaries and
the wavepacket wraps around the edges of the simulation box (red).
The time evolution is portrayed together with a
momentum space momentum-space representation (yellow), with spacing $\Delta k$
and maximum momentum $k_{\rm max}$, in three situations differing in the strategy used to map real and
momentum spaces:(a) Fast Fourier Transform (FFT), (b) FFT extended with zeros (zero padding) in a box enlarged
by a factor $\alpha$, and (c) zero padding with NFFT.