[ViewVC] Log of: group/trunk/OOPSE-4/samples/water/ssd/ssd.md

Revision 2990 - (view) (annotate) - [select for diffs]
Modified Thu Aug 31 20:12:12 2006 UTC (17 years, 9 months ago) by chrisfen
File length: 55972 byte(s)
Diff to previous 2820

converted samples over to the OOPSE-4 file format

Fixed an MPI bug in thermodynamic integration

Revision 2820 - (view) (annotate) - [select for diffs]
Modified Wed Jun 7 22:49:26 2006 UTC (18 years ago) by chrisfen
File length: 463 byte(s)
Diff to previous 2759

damping now works for charge-quadrupole and dipole-dipole

Revision 2759 - (view) (annotate) - [select for diffs]
Modified Wed May 17 21:51:42 2006 UTC (18 years, 1 month ago) by tim
File length: 400 byte(s)
Diff to previous 2727

Adding single precision capabilities to c++ side

Revision 2727 - (view) (annotate) - [select for diffs]
Modified Fri Apr 21 19:32:07 2006 UTC (18 years, 2 months ago) by chrisfen
File length: 400 byte(s)
Diff to previous 2489

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 2489 - (view) (annotate) - [select for diffs]
Modified Tue Dec 6 16:49:59 2005 UTC (18 years, 6 months ago) by tim
File length: 471 byte(s)
Diff to previous 2423

remove deprecated keywords from samples

Revision 2423 - (view) (annotate) - [select for diffs]
Modified Fri Nov 11 15:21:25 2005 UTC (18 years, 7 months ago) by chrisfen
File length: 504 byte(s)
Diff to previous 2338

playing with switching functions again

Revision 2338 - (view) (annotate) - [select for diffs]
Modified Wed Sep 28 18:47:01 2005 UTC (18 years, 9 months ago) by chrisfen
File length: 454 byte(s)
Diff to previous 2326

fixed some samples

Revision 2326 - (view) (annotate) - [select for diffs]
Modified Mon Sep 26 14:27:53 2005 UTC (18 years, 9 months ago) by chrisfen
File length: 453 byte(s)
Diff to previous 2258

fixing up some samples

Revision 2258 - (view) (annotate) - [select for diffs]
Modified Mon Jun 20 16:03:30 2005 UTC (19 years ago) by gezelter
File length: 444 byte(s)
Diff to previous 2154

fixed a bug and ran a simulation

Revision 2154 - (view) (annotate) - [select for diffs]
Modified Fri Apr 8 18:48:04 2005 UTC (19 years, 2 months ago) by chrisfen
File length: 442 byte(s)
Diff to previous 2152

oops...  messed up a sample

Revision 2152 - (view) (annotate) - [select for diffs]
Modified Fri Apr 8 14:42:27 2005 UTC (19 years, 2 months ago) by chrisfen
File length: 442 byte(s)
Diff to previous 1705

changes during debug of charge-dipole

Revision 1705 - (view) (annotate) - [select for diffs]
Modified Thu Nov 4 16:20:02 2004 UTC (19 years, 7 months ago) by gezelter
File length: 401 byte(s)
Diff to previous 1490

testing force fields

Revision 1490 - (view) (annotate) - [select for diffs]
Added Fri Sep 24 04:16:43 2004 UTC (19 years, 9 months ago) by gezelter
File length: 401 byte(s)

Import of OOPSE v. 2.0

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