HI, Bruce and Matt For the Demeter version I am using, I found that I could just enter 8 atoms in ATOM, and define 12 variables in GDS. Could I enter more atoms in ATOMS, and define more variables in GDS? and How? Thanks. Dien Li, Ph.D. Environmental Sciences and Biotechnology Savannah River National Laboratory Aiken, South Carolina, 29808 Tel: 803-725-7520
On 07/14/2014 04:25 PM, Dien.Li@srs.gov wrote:
For the Demeter version I am using, I found that I could just enter 8 atoms in ATOM, and define 12 variables in GDS. Could I enter more atoms in ATOMS, and define more variables in GDS? and How? Thanks.
The fact that the "add site" button on the atoms page was broken is among the things on the list of changes for the version I have been working to get tested and released. https://github.com/bruceravel/demeter/blob/master/Changes.org As for the GDS page, there are several ways of adding a new GDS entry, described here http://bruceravel.github.io/demeter/artug/gds.html On the path page, in the box which contains the math expression for a path parameter, try right clicking on GDS parameter. It'll pop up a menu that allows you to define a new parameter. It seems I neglected to put that last thing in the document -- that needs to be fixed. B -- Bruce Ravel ------------------------------------ bravel@bnl.gov National Institute of Standards and Technology Synchrotron Science Group at NSLS --- Beamlines U7A, X24A, X23A2 Building 535A Upton NY, 11973 Homepage: http://xafs.org/BruceRavel Software: https://github.com/bruceravel
Hi Dien Li, I had the same problem with ATOM in Demeter version 0.9.18 used in Windows 7, the "Add a site" icon doesn't work for me for some reasons. To add another row of atomic coordinate, what works for me is: 1. right click on any space on the table of atomic coordinate. 2. choose "Copy site" 3. right click again 4. choose "Paste site" [cid:image001.png@01CFA05A.7CE0C5C0] Hope this helps, Sin Yuen -- Sin Yuen, Chang PhD Student, School of Chemical Engineering and Analytical Science, The University of Manchester, M13 9PL Manchester. From: ifeffit-bounces@millenia.cars.aps.anl.gov [mailto:ifeffit-bounces@millenia.cars.aps.anl.gov] On Behalf Of Dien.Li@srs.gov Sent: 14 July 2014 21:26 To: ifeffit@millenia.cars.aps.anl.gov Subject: [Ifeffit] ATOM and GDS HI, Bruce and Matt For the Demeter version I am using, I found that I could just enter 8 atoms in ATOM, and define 12 variables in GDS. Could I enter more atoms in ATOMS, and define more variables in GDS? and How? Thanks. Dien Li, Ph.D. Environmental Sciences and Biotechnology Savannah River National Laboratory Aiken, South Carolina, 29808 Tel: 803-725-7520
On 07/15/2014 01:27 PM, Sin Yuen Chang wrote:
I had the same problem with ATOM in Demeter version 0.9.18 used in Windows 7, the “Add a site” icon doesn’t work for me for some reasons.
As I said, that is a known problem that is on the list of improvements in the next version. If you download any of the trial versions that have been discussed on the list in the recent weeks, you will find that has been fixed. B -- Bruce Ravel ------------------------------------ bravel@bnl.gov National Institute of Standards and Technology Synchrotron Science Group at NSLS --- Beamlines U7A, X24A, X23A2 Building 535A Upton NY, 11973 Homepage: http://bruceravel.github.io/home/ Software: https://github.com/bruceravel Demeter: http://bruceravel.github.io/demeter/
participants (3)
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Bruce Ravel -
Dien.Li＠srs.gov -
Sin Yuen Chang