[ViewVC] Log of: OpenMD/branches/development/samples/water/ssdrf/ssdrf.md

Revision 1465 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 23:08:25 2010 UTC (15 years ago) by chuckv
File length: 56009 byte(s)
Diff to previous 1390

Creating busticated version of OpenMD

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Modified Wed Nov 25 20:02:06 2009 UTC (15 years, 8 months ago) by gezelter
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 56009 byte(s)
Diff to previous 1028

Almost all of the changes necessary to create OpenMD out of our old
project (OOPSE-4)

Revision 1028 - (view) (annotate) - [select for diffs]
Modified Thu Aug 31 20:12:12 2006 UTC (18 years, 11 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 56007 byte(s)
Diff to previous 942

converted samples over to the OOPSE-4 file format

Fixed an MPI bug in thermodynamic integration

Revision 942 - (view) (annotate) - [select for diffs]
Modified Fri Apr 21 19:32:07 2006 UTC (19 years, 3 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 500 byte(s)
Diff to previous 790

Removed sqrt splines and shape stuff (doesn't work, so why was it in there?).  Changed some of the water samples to use shifted_force.  Probably should set the defaults to use the damped version now that we sped it up.

Revision 790 - (view) (annotate) - [select for diffs]
Modified Tue Dec 6 16:49:59 2005 UTC (19 years, 7 months ago) by tim
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 499 byte(s)
Diff to previous 694

remove deprecated keywords from samples

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Modified Sun Oct 23 21:07:06 2005 UTC (19 years, 9 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 515 byte(s)
Diff to previous 690

minor changes when testing reaction field

Revision 690 - (view) (annotate) - [select for diffs]
Modified Wed Oct 19 19:23:38 2005 UTC (19 years, 9 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 515 byte(s)
Diff to previous 625

nothing

Revision 625 - (view) (annotate) - [select for diffs]
Modified Sat Sep 24 17:38:10 2005 UTC (19 years, 10 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 515 byte(s)
Diff to previous 612

turned rf on

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Modified Tue Sep 20 15:34:15 2005 UTC (19 years, 10 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 518 byte(s)
Diff to previous 611

fixed up some sample md files

Revision 611 - (view) (annotate) - [select for diffs]
Modified Mon Sep 19 23:21:46 2005 UTC (19 years, 10 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 508 byte(s)
Diff to previous 610

Fixed bugs in reaction field, now it appears as though it really is working...

Revision 610 - (view) (annotate) - [select for diffs]
Modified Sun Sep 18 20:45:38 2005 UTC (19 years, 10 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 518 byte(s)
Diff to previous 375

reaction field seems to work now, still need to do some testing...

Revision 375 - (view) (annotate) - [select for diffs]
Added Tue Feb 22 19:26:05 2005 UTC (20 years, 5 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/ssdrf.md
File length: 496 byte(s)

Added ssdrf sample

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