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WarwickMicroscopy / Felix

Felix: Bloch wave method diffraction pattern simulation software
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Angle Correction for Surface Normal #191

Closed Chris-Cumming closed 2 years ago

Chris-Cumming commented 2 years ago

Hi Richard,

You should be able to see the changes made to the code in the bloch_mod_mine.f90 file, which shows how I am hoping to implement the code into the original bloch_mod.f90 file, it should start on line 706.

Whilst the refinementcontrol_mod_mine.f90 just shows how the subroutine will be called once simulate() is called in felix, on line 237.

The rest are just changes made to the SrTiO3 input files that allow the SrTiO3 sampes to be run.

All the best

Chris

Chris-Cumming commented 2 years ago

Compile error was fixed accidentally by moving AngleCorrection() subroutine from bloch_mod to refinementcontrol_mod, and then back to bloch_mod in order to try and fix error where had to -make twice for compilation to be successful. So now no longer need to -make twice for successful compilation, only one -make required. Will need to keep an eye on this.