[RMCProfile-users] [EXTERNAL] Re: get_gsas_bragg

[Poree Victor Alexis (PSI)]

Dear Matt,

Thank you for your email.

Yes, I was not very clear in my email but I followed this route and have all the required files except the .bragg ... Unfortunate the screenshots I send with my email did not go through. Here they are.

Best regards,

Victor

On 10.12.19, 14:49, "rmcprofile-users on behalf of Tucker, Matthew G." <rmcprofile-users-bounces at shadow.nd.rl.ac.uk on behalf of tuckermg at ornl.gov> wrote:

    Hi Victor,
    
    Did you follow the instructions in appendix A of the tutorial to prepare the GSAS files? If not please have a look and let us know how you get on. 
    
    Best wishes,
    Matt
    
    On 12/10/19, 7:08 AM, "rmcprofile-users on behalf of Poree Victor Alexis (PSI)" <rmcprofile-users-bounces at shadow.nd.rl.ac.uk on behalf of victor.poree at psi.ch> wrote:
    
        Hello,
        
        That's what I used to get the .back, .inst etc. But it did not generate a .bragg.
        
        Best,
        
        Victor
        
        On 10.12.19, 12:53, "rmcprofile-users on behalf of Martin Dove" <rmcprofile-users-bounces at shadow.nd.rl.ac.uk on behalf of martin.dove at qmul.ac.uk> wrote:
        
            Why don’t you use data2config to do it?
            
            Best wishes
            
            Martin
            
            > On 5 Dec 2019, at 16:47, Poree Victor Alexis (PSI) <victor.poree at psi.ch> wrote:
            > 
            > Dear all,
            > 
            > I am setting up the starting files to begin my RMCProfile simulation.
            > 
            > I have used GSAS to fit the data (obtained on GEM) under windows (the Mac version is not cooperating). I have generated the .back, .inst etc using the RMCProfile tools. However I cannot obtain the .bragg. I tried using the get_gsas_bragg command but I get the following errors in both Mac and windows (see attachment).
            > 
            > What should I do to solve this and get starting with the RMC?
            > 
            > Best regards,
            > 
            > Victor Porée
            > ----------------------------
            > Laboratory for Neutron Scattering and Imaging (LNS)
            > Paul Scherrer Institut
            > WHGA 142
            > Forschungsstrasse 111
            > 5232 Villligen PSI
            > Phone: +41 56 310 36 23
            > victor.poree at psi.ch<mailto:victor.poree at psi.ch>
            > 
            > 
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