[ViewVC] Log of: OpenMD/branches/development/src/integrators/SMIPDForceManager.hpp

Revision 1465 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 23:08:25 2010 UTC (14 years, 9 months ago) by chuckv
File length: 3549 byte(s)
Diff to previous 1464

Creating busticated version of OpenMD

Revision 1464 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 19:29:05 2010 UTC (14 years, 9 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3549 byte(s)
Diff to previous 1442

removing cruft (atom numbers, do_pot, do_stress) from many modules and
force managers

Revision 1442 - (view) (annotate) - [select for diffs]
Modified Mon May 10 17:28:26 2010 UTC (14 years, 11 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3564 byte(s)
Diff to previous 1402

Adding property set to svn entries

Revision 1402 - (view) (annotate) - [select for diffs]
Modified Fri Jan 8 17:15:27 2010 UTC (15 years, 3 months ago) by chuckv
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3564 byte(s)
Diff to previous 1398

Added preliminary code for Alpha Hull calculation using qhull.
Added preliminary support to SMIPD to support Alpha Hull.
Alpha Hull does not yet add the correct things to triangle to be returned to SMPID. 
Preliminary changes for shadow hamiltonian integrator.
Chages to md files so they will work in openMD.

Revision 1398 - (view) (annotate) - [select for diffs]
Modified Tue Dec 8 22:17:02 2009 UTC (15 years, 4 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3373 byte(s)
Diff to previous 1390

Parallel bugfix in RestraintForceManager
Reverted back to hydrodynamics on triangular plates for SMIPDForceManager
Removed thermalLength and thermalConductivity keywords from Globals.
Bug tracking in openmdformat (not yet resolved).

Revision 1390 - (view) (annotate) - [select for diffs]
Modified Wed Nov 25 20:02:06 2009 UTC (15 years, 5 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3412 byte(s)
Diff to previous 1357

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

Revision 1357 - (view) (annotate) - [select for diffs]
Modified Thu Jul 23 18:49:45 2009 UTC (15 years, 9 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3369 byte(s)
Diff to previous 1355

New hotness

Revision 1355 - (view) (annotate) - [select for diffs]
Modified Mon Jul 20 17:50:40 2009 UTC (15 years, 9 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3389 byte(s)
Diff to previous 1344

Latest version of SMIPD with gamma set to thermal conductivity

Revision 1344 - (view) (annotate) - [select for diffs]
Modified Wed May 13 22:27:29 2009 UTC (15 years, 11 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3301 byte(s)
Diff to previous 1325

Adding boundary element hydrodynamics to SMIPD.

Revision 1325 - (view) (annotate) - [select for diffs]
Modified Fri Dec 5 16:20:39 2008 UTC (16 years, 4 months ago) by chuckv
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 4012 byte(s)
Diff to previous 1324

Different method again for Langevin Dynamics.

Revision 1324 - (view) (annotate) - [select for diffs]
Modified Wed Nov 26 14:26:17 2008 UTC (16 years, 5 months ago) by gezelter
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3273 byte(s)
Diff to previous 1323

Cleaning up some cruft.

Revision 1323 - (view) (annotate) - [select for diffs]
Modified Tue Nov 25 16:32:47 2008 UTC (16 years, 5 months ago) by chuckv
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 3920 byte(s)
Diff to previous 1307

Code clean-up. Removed old langevin code.

Revision 1307 - (view) (annotate) - [select for diffs]
Modified Mon Oct 20 19:36:32 2008 UTC (16 years, 6 months ago) by chuckv
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 4310 byte(s)
Diff to previous 1293

More changes to SMIPD. Attempting to find memory leak.

Revision 1293 - (view) (annotate) - [select for diffs]
Added Sun Sep 14 01:32:26 2008 UTC (16 years, 7 months ago) by chuckv
Original Path: trunk/src/integrators/SMIPDForceManager.hpp
File length: 4287 byte(s)

Added large quantities of code for convex hull and constant pressure langevin dynamics.

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