[RMCProfile-users] EXAFS example

[Dylan Fast]

Dear Igor,

I am just getting started so apologies if I am unclear about any of this.
>From what I can tell I am missing the EXAFS_INTER.exe and SCAT_ABS.exe from
the executables folder of version 6.5.2. Version 6.5.1 has SCAT_ABS
included but seems to be missing the other executable still. Have these
been removed for revisions or am I just missing something?

To give you a little insight to the problem we are working on, we have
X-ray and neutron total scattering on some amorphous mixed metal oxide
films that we have used for some models in RMCProfile already. We recently
got some EXAFS data that we would like to incorporate into the model as
well. I have worked it up in Athena and Artemis and am just looking to get
started on the process of incorporating it into the RMC calculations.

Please let me know if you need any additional information. Thank you for
your help!

Best Regards,

Dylan Fast
Oregon State University
Dept. of Chemistry

On Wed, Jul 15, 2015 at 3:59 AM, Levin, Igor <igor.levin at nist.gov> wrote:

>
>  Dear Dylan,
>
>
>  please explain your problem in more detail and we will get you
> going.  are you missing  the executables for the utilities that prepare
> exafs data for refinements?
>
>
>  Igor
>  ------------------------------
> *From:* rmcprofile-users <rmcprofile-users-bounces at rmcprofile.org> on
> behalf of Dylan Fast <fastd at onid.orst.edu>
> *Sent:* Tuesday, July 14, 2015 2:12 PM
> *To:* rmcprofile-users at rmcprofile.org
> *Subject:* Re: [RMCProfile-users] EXAFS example
>
>  Dear Dr. Playford,
>
>  I would like to follow up on the subject of this email if possible. I
> have some EXAFS data that I would like to try to incorporate into an x-ray
> PDF model that we have already made. Do you think you might have some time
> to discuss the logistics of this with me? The executables mentioned in the
> RMCProfile EXAFS manual do not seem to be included in the latest version.
>
>  Thank you very much for your help! Please let me know if you have any
> questions.
>
>  Best Regards,
>
>  Dylan Fast
> Oregon State University
> Dept. of Chemistry
>
> On Mon, Mar 2, 2015 at 3:50 AM, <helen.playford at stfc.ac.uk> wrote:
>
>>  Dear Carlos,
>>
>>
>>
>> We’ve recently been working on updating the EXAFS tutorial and that will
>> be available in a future release (hopefully soon) so the examples mentioned
>> in the EXAFS manual are not really applicable at present. If you have EXAFS
>> data ready and are keen to get going, please drop me an email and we can
>> discuss off-the-list the best way forward.
>>
>>
>>
>> Best wishes,
>>
>> Helen
>>
>>
>>
>> *From:* rmcprofile-users [mailto:rmcprofile-users-bounces at rmcprofile.org]
>> *On Behalf Of *Carlos Triana Estupinan
>> *Sent:* 19 February 2015 21:31
>> *To:* rmcprofile-users at rmcprofile.org
>> *Subject:* [RMCProfile-users] EXAFS example
>>
>>
>>
>> DEAR
>>
>> RMC group
>>
>>
>>
>> I want to know how can I get the files necessaries to run the EXAFS
>> examples, since those files no appear in the folder I download months ago.
>> Could you please tell me how can I get those files.
>>
>>
>>
>> best
>>
>>
>>
>>
>>
>> --
>>
>>
>>
>>
>>
>>
>>
>>
>>
>>
>>
>> *Carlos Augusto Triana Estupiñan (C.A. Triana-E) Physicist M.Sc. In
>> Physical Sciences-Research PhD Student-Research Ångströmlaboratoriet,
>> Lägerhyddsv. 1 Solid State physics Uppsala University, Box 534 751 21
>> Uppsala, Sweden Tel: +46 018 471 3144 <%2B46%20018%20471%203144>
>> e-mail:carlos.triana at angstrom.uu.se <e-mail%3Acarlos.triana at angstrom.uu.se>
>> web:http://www.uu.se/ <http://www.uu.se/>*
>>
>> _______________________________________________
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>>
>>
>
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