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

Revision 1670 - (view) (annotate) - [select for diffs]
Modified Fri Jan 27 19:07:19 2012 UTC (14 years, 1 month ago) by chuckv
File length: 3749 byte(s)
Diff to previous 1393

Adding experimental branch for calculation of the heatflux based on old version of OpenMD.
This will need to be ported to the development branch later.

Revision 1393 - (view) (annotate) - [select for diffs]
Modified Wed Nov 25 20:36:46 2009 UTC (16 years, 3 months ago) by gezelter
Original Path: trunk/samples/water/ssdrf/water.md
File length: 3749 byte(s)
Diff to previous 1009

removing spurious cutoffGroup lines from default water.md sample files

Revision 1009 - (view) (annotate) - [select for diffs]
Modified Wed Jul 19 12:46:20 2006 UTC (19 years, 7 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/water.md
File length: 4164 byte(s)
Diff to previous 979

Added tred to sample water.md files

Revision 979 - (view) (annotate) - [select for diffs]
Modified Thu May 25 21:40:57 2006 UTC (19 years, 9 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/water.md
File length: 3885 byte(s)
Diff to previous 790

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

Revision 790 - (view) (annotate) - [select for diffs]
Modified Tue Dec 6 16:49:59 2005 UTC (20 years, 2 months ago) by tim
Original Path: trunk/samples/water/ssdrf/water.md
File length: 3809 byte(s)
Diff to previous 698

remove deprecated keywords from samples

Revision 698 - (view) (annotate) - [select for diffs]
Modified Wed Oct 26 23:30:52 2005 UTC (20 years, 4 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/water.md
File length: 4422 byte(s)
Diff to previous 650

added a test molecule

Revision 650 - (view) (annotate) - [select for diffs]
Modified Thu Oct 6 18:44:32 2005 UTC (20 years, 4 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/water.md
File length: 3879 byte(s)
Diff to previous 519

fixing up the samples

Revision 519 - (view) (annotate) - [select for diffs]
Modified Fri Apr 29 16:26:27 2005 UTC (20 years, 10 months ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/water.md
File length: 3669 byte(s)
Diff to previous 375

Added TIP4P-Ew

Revision 375 - (view) (annotate) - [select for diffs]
Added Tue Feb 22 19:26:05 2005 UTC (21 years ago) by chrisfen
Original Path: trunk/samples/water/ssdrf/water.md
File length: 3140 byte(s)

Added ssdrf sample

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