SHXABS - EMPIRICAL ABSORPTION CORRECTION
Empirical correction for absorption based on the modelling of the
absorption surface with spherical harmonics using the difference
between I(obs) and I(calc). This implementation is similar but not
identical to SHELXA. I(obs) is calculated from the model present in the
'.res' file. This file may contain a HKLF line carrying a transformation
matrix.
The correction is attempted, based on a '.res' and '.hkl' file.
Structure factors are calculated based on the data in the '.res' file.
The 'corrected' data are written to a '.hkp' file.
Note: the usual warnings for the application of empirical correction
techniques apply.
ABSORPTION CORRECTION
TOOLS
PLATON HOMEPAGE
12-Nov-2001 A.L.Spek