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rneder committed Jul 24, 2020
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13 changes: 8 additions & 5 deletions discus/prog/appl_dis.hlp
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Starts the Fourier calculation.

The optional parameters enable you to apply a convolution with a
triaxial Gaussian resolution function. The sigma and the directions
for the three half axes of the ellipsoid are independent. The
directions <h>, <k>, <l> can be omitted. In this case the directions
default to the abscissa, ordinate and top axis of the Fourier
calculation.
triaxial Gaussian resolution function.
The sigma's are in units of reciprocal Angstrom, keep in mind that
DISCUS uses the definition a* = 1/a instead of a* = 2pi/a.

The sigma and the directions for the three half axes of the
ellipsoid are independent. The directions <h>, <k>, <l> can be
omitted. In this case the directions default to the abscissa,
ordinate and top axis of the Fourier calculation.
3 scat
!p scat { <name> | <number> },<a1>,<b1>,<a2>,<b2>,<a3>,<b3>,<a4>,<b4>,<c>
!p scat { <name> | <number> | "all" }, <name>
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