[RMCProfile-users] X-Ray PDF refinement

Chris Kerr cjk34 at cam.ac.uk
Mon Apr 28 09:41:17 BST 2014

1) The START_POINT and END_POINT keywords are probably what you want - 
see page 40 and 41 of the manual.

2) Use the atomic symbol "Va" (Vacancy).

On Friday 11 Apr 2014 14:03:11 Wojciech Slawinski wrote:
> Dear Users,
> I am new in a field so please forgive me if I am asking a trivial question.
> Finally I have gone through all the exercise and I have just started my
> own calculation. I have the following questions:
> 1. What way I can define the range to be refined for PDF analyzis?
> 2. What way I can model voids in the structure? Just by adding a new
> atom type with 0.0 "neutron coefficient"?
> Thanks a lot,
> Wojtek
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> rmcprofile-users at rmcprofile.org
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