Revision 1647 - Directory Listing - [select for diffs]
Modified Mon Sep 26 21:20:11 2011 UTC (14 years, 1 month ago) by gezelter
Diff to previous 1465 , to selected 790

fixing the build system

Creating busticated version of OpenMD

Revision 1393 - Directory Listing - [select for diffs]
Modified Wed Nov 25 20:36:46 2009 UTC (15 years, 11 months ago) by gezelter
Original Path: trunk/samples/water/ssdrf
Diff to previous 1390 , to selected 790

removing spurious cutoffGroup lines from default water.md sample files

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

Revision 1146 - Directory Listing - [select for diffs]
Modified Sat Jun 2 20:53:20 2007 UTC (18 years, 5 months ago) by chuckv
Original Path: trunk/samples/water/ssdrf
Diff to previous 1028 , to selected 790

Fixed Makefile problems with the samples and added several missing makefiles.

converted samples over to the OOPSE-4 file format

Fixed an MPI bug in thermodynamic integration

Revision 1009 - Directory Listing - [select for diffs]
Modified Wed Jul 19 12:46:20 2006 UTC (19 years, 3 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
Diff to previous 979 , to selected 790

Added tred to sample water.md files

Added TIP5P-E and fixed a bug for Thermodynamic integration (you can now have a lambda of 0)

Revision 942 - Directory Listing - [select for diffs]
Modified Fri Apr 21 19:32:07 2006 UTC (19 years, 6 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
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.

remove deprecated keywords from samples

Revision 698 - Directory Listing - [select for diffs]
Modified Wed Oct 26 23:30:52 2005 UTC (20 years ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
Diff to previous 694 , to selected 790

added a test molecule

minor changes when testing reaction field

Revision 690 - Directory Listing - [select for diffs]
Modified Wed Oct 19 19:23:38 2005 UTC (20 years ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
Diff to previous 650 , to selected 790

nothing

fixing up the samples

Revision 625 - Directory Listing - [select for diffs]
Modified Sat Sep 24 17:38:10 2005 UTC (20 years, 1 month ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
Diff to previous 612 , to selected 790

turned rf on

fixed up some sample md files

Revision 611 - Directory Listing - [select for diffs]
Modified Mon Sep 19 23:21:46 2005 UTC (20 years, 1 month ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
Diff to previous 610 , to selected 790

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

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

Revision 519 - Directory Listing - [select for diffs]
Modified Fri Apr 29 16:26:27 2005 UTC (20 years, 6 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
Diff to previous 503 , to selected 790

Added TIP4P-Ew

some samples are not installed correctly

Revision 375 - Directory Listing - [select for diffs]
Added Tue Feb 22 19:26:05 2005 UTC (20 years, 8 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf
Diff to selected 790

Added ssdrf sample