RE: new GSAS (EXPGUI)
Larry, I knew about this but was hoping that there was a way within Windows to keep the window open. Bob At 06:53 PM 4/14/01 -0700, you wrote: Bob, At 08:06 AM 4/12/01 -0600, you wrote: 2) is it correct that using PC-GSAS the windows automatically close after the program finish? From my point of view it should better to have the possibility to read the refinement results Yes, but I like the windows to stay open too. I havn't found out how tho. Any suggestions are welcome. In my Visual Basic Shell for GSAS, I call the following batch file rather than the executable directly. One only needs to keep the window open for GENLES and a few other programs. @echo off %1 %2 %3 %4 pause I named the script vb-gsas.bat, thus the call to GENLES is vb-gsas.bat genles experiment.exp. The extra arguments take care of any contingencies. Larry -- Larry W. Finger [EMAIL PROTECTED] 1400 Colorado St.Phone: +1 (240) 463-2051 Boulder City, NV 89005 FAX: +1 (209) 844-9855 http://www.lwfinger.net/ Note New URL and E-mail address
RE: new GSAS (EXPGUI)
Bob, At 08:06 AM 4/12/01 -0600, you wrote: 2) is it correct that using PC-GSAS the windows automatically close after the program finish? From my point of view it should better to have the possibility to read the refinement results Yes, but I like the windows to stay open too. I havn't found out how tho. Any suggestions are welcome. In my Visual Basic Shell for GSAS, I call the following batch file rather than the executable directly. One only needs to keep the window open for GENLES and a few other programs. @echo off %1 %2 %3 %4 pause I named the script vb-gsas.bat, thus the call to GENLES is vb-gsas.bat genles experiment.exp. The extra arguments take care of any contingencies. Larry -- Larry W. Finger [EMAIL PROTECTED] 1400 Colorado St.Phone: +1 (240) 463-2051 Boulder City, NV 89005 FAX: +1 (209) 844-9855 http://www.lwfinger.net/ Note New URL and E-mail address
RE: new GSAS (EXPGUI)
Dear Bob, I have a couple of question: 1) when I try to use LINUX GSAS powpref and genles say that exp file it is not complete, but Expedt read it after a conversion. what I should do? I already tried to use convert but nothing change! 2) is it correct that using PC-GSAS the windows automatically close after the program finish? From my point of view it should better to have the possibility to read the refinement results all the best Davide -Original Message- From: Bob Von Dreele [mailto:[EMAIL PROTECTED]] Sent: 11 April 2001 21:29 To: [EMAIL PROTECTED] Subject: Re: new GSAS (EXPGUI) Hi Armel, Ah well. I did have that as a plan a long time ago. Well I do the "official" version. Bob At 08:41 PM 4/11/01 +0200, you wrote: Hello Bob, Attached is the new Linux version (with fixes). Ooops. Now that the GSAS Fortran source is in the mailboxes of 300 subscribers of the Rietveld mailing list as well as in the list archives, may I add it in the Crystallography Source Code Museum ?-). Armel http://sdpd.univ-lemans.fr/museum/
RE: new GSAS (EXPGUI)
Dear Davide, At 11:40 AM 4/12/01 +0200, you wrote: Dear Bob, I have a couple of question: 1) when I try to use LINUX GSAS powpref and genles say that exp file it is not complete, but Expedt read it after a conversion. what I should do? I already tried to use convert but nothing change! That is the proper response from EXPEDT with an old Linux EXP file; the file is permanently fixed. The old one is still around as a CRD file. Get rid of any old "convert" routine and use CNVFILE to fix EXP rawfiles. 2) is it correct that using PC-GSAS the windows automatically close after the program finish? From my point of view it should better to have the possibility to read the refinement results Yes, but I like the windows to stay open too. I havn't found out how tho. Any suggestions are welcome. Bob all the best Davide -Original Message- From: Bob Von Dreele [mailto:[EMAIL PROTECTED]] Sent: 11 April 2001 21:29 To: [EMAIL PROTECTED] Subject: Re: new GSAS (EXPGUI) Hi Armel, Ah well. I did have that as a plan a long time ago. Well I do the "official" version. Bob At 08:41 PM 4/11/01 +0200, you wrote: Hello Bob, Attached is the new Linux version (with fixes). Ooops. Now that the GSAS Fortran source is in the mailboxes of 300 subscribers of the Rietveld mailing list as well as in the list archives, may I add it in the Crystallography Source Code Museum ?-). Armel http://sdpd.univ-lemans.fr/museum/
Re: new GSAS (EXPGUI)
Brian, Attached is the new Linux version (with fixes). This has the new VERSION version and a fix to the texture stuff. Apparently the g77 version of atan2 doesn't know what to do with atan2(0,0). Use this one for the SGI. Bob gsassource.tar.gz
Re: new GSAS (EXPGUI)
Hello Bob, Attached is the new Linux version (with fixes). Ooops. Now that the GSAS Fortran source is in the mailboxes of 300 subscribers of the Rietveld mailing list as well as in the list archives, may I add it in the Crystallography Source Code Museum ?-). Armel http://sdpd.univ-lemans.fr/museum/
Re: new GSAS (EXPGUI)
Hi Armel, Ah well. I did have that as a plan a long time ago. Well I do the "official" version. Bob At 08:41 PM 4/11/01 +0200, you wrote: Hello Bob, Attached is the new Linux version (with fixes). Ooops. Now that the GSAS Fortran source is in the mailboxes of 300 subscribers of the Rietveld mailing list as well as in the list archives, may I add it in the Crystallography Source Code Museum ?-). Armel http://sdpd.univ-lemans.fr/museum/
Re: new GSAS (EXPGUI)
Anthony Manerbino wrote: Is the program expgui used instead of the routine expedt for entering structural information and bring experimental patterns into GSAS? In a word, yes. EXPGUI does only a fraction of what EXPEDT does, but I would like to think it is pretty useful. See http://www.ncnr.nist.gov/xtal/software/expgui/expgui_intro.html for more info. Brian P.S. The current version should work fine with the latest GSAS release for Windows, but I have not yet gotten my act together for the "beta" Linux release. Brian H. Toby, Ph.D.Leader, Crystallography Team [EMAIL PROTECTED] NIST Center for Neutron Research, Stop 8562 voice: 301-975-4297 National Institute of Standards Technology FAX: 301-921-9847Gaithersburg, MD 20899-8562 http://www.ncnr.nist.gov/xtal
