NUMERICAL-ABSORB

4.1 - Numerical Absorption Corrections


These methods provide mathematically exact absorption corrections, providing of course that the input data are correct. The first two methods require that the crystal faces have been indexed, and the distances of the crystal faces from the centre of rotation have been measured. This can be very difficult to do accurately.

The auxilliary program XtalView is provided as a useful check that the proposed set of indices and distances accurately describe the crystal. XtalView reads the file FACES.DEF and allows the user to edit it interactively. This file is read (or created) by the programs ANALYTICAL and GAUSSIAN.