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||number of points for gauss integration
||number of points for FFT
NFFT sets the number of points for the FFT of the local potential and
the charge densities.
Default is 32768, and must not be changed except for testing the
MD supplies the number of points for a gauss integration
used in certain parts of the code.
Default is 64, and must not be changed except for testing the
accuracy. The next smaller possible value is 48.
N.B. Requests for support are to be addressed to: firstname.lastname@example.org