[ViewVC] Log of: OpenMD/branches/development/src/nonbonded/SC.cpp

Revision 1711 - (view) (annotate) - [select for diffs]
Modified Sat May 19 02:58:35 2012 UTC (12 years, 11 months ago) by gezelter
File length: 10990 byte(s)
Diff to previous 1710

Some fixes for DataStorage issues.  Removed outdated zangle stuff that
has been replaced by the more modern restraints.

Revision 1710 - (view) (annotate) - [select for diffs]
Modified Fri May 18 21:44:02 2012 UTC (12 years, 11 months ago) by gezelter
File length: 10895 byte(s)
Diff to previous 1665

Added an adapter layer between the AtomType and the rest of the code to 
handle the bolt-on capabilities of new types. 

Fixed a long-standing bug in how storageLayout was being set to the maximum
possible value.

Started to add infrastructure for Polarizable and fluc-Q calculations.

Revision 1665 - (view) (annotate) - [select for diffs]
Modified Tue Nov 22 20:38:56 2011 UTC (13 years, 5 months ago) by gezelter
File length: 12260 byte(s)
Diff to previous 1586

updated copyright notices

Revision 1586 - (view) (annotate) - [select for diffs]
Modified Tue Jun 21 06:34:35 2011 UTC (13 years, 10 months ago) by gezelter
File length: 12194 byte(s)
Diff to previous 1583

bug fixes

Revision 1583 - (view) (annotate) - [select for diffs]
Modified Thu Jun 16 22:00:08 2011 UTC (13 years, 10 months ago) by gezelter
File length: 12194 byte(s)
Diff to previous 1582

Bug squashing

Revision 1582 - (view) (annotate) - [select for diffs]
Modified Tue Jun 14 20:41:44 2011 UTC (13 years, 10 months ago) by gezelter
File length: 12189 byte(s)
Diff to previous 1575

Well, the potential energy values are still garbage, but the LJ sample
runs.

Revision 1575 - (view) (annotate) - [select for diffs]
Modified Fri Jun 3 21:39:49 2011 UTC (13 years, 10 months ago) by gezelter
File length: 12184 byte(s)
Diff to previous 1571

more parallel fixes

Revision 1571 - (view) (annotate) - [select for diffs]
Modified Fri May 27 16:45:44 2011 UTC (13 years, 11 months ago) by gezelter
File length: 12240 byte(s)
Diff to previous 1554

Added Atypes to new C++ force decomposition.

Revision 1554 - (view) (annotate) - [select for diffs]
Modified Sat Apr 30 02:54:02 2011 UTC (14 years ago) by gezelter
File length: 12248 byte(s)
Diff to previous 1549

For efficiency, pointers instead of objects will be passed during main
force loop.

Revision 1549 - (view) (annotate) - [select for diffs]
Modified Wed Apr 27 18:38:15 2011 UTC (14 years ago) by gezelter
File length: 12128 byte(s)
Diff to previous 1545

a few more tweaks   We're getting somewhat closer to deleting fortran.

Revision 1545 - (view) (annotate) - [select for diffs]
Modified Fri Apr 8 21:25:19 2011 UTC (14 years ago) by gezelter
File length: 12131 byte(s)
Diff to previous 1536

still busted, but much progress

Revision 1536 - (view) (annotate) - [select for diffs]
Modified Wed Jan 5 14:49:05 2011 UTC (14 years, 3 months ago) by gezelter
File length: 12218 byte(s)
Diff to previous 1505

compiles, builds and runs, but is very slow

Revision 1505 - (view) (annotate) - [select for diffs]
Modified Sun Oct 3 22:18:59 2010 UTC (14 years, 6 months ago) by gezelter
File length: 12209 byte(s)
Diff to previous 1502

Less busted than it was on last check-in, but still won't completely
build.

Revision 1502 - (view) (annotate) - [select for diffs]
Modified Sat Oct 2 19:53:32 2010 UTC (14 years, 7 months ago) by gezelter
File length: 11795 byte(s)
Diff to previous 1489

Many changes, and we're not quite done with this phase yet.

Revision 1489 - (view) (annotate) - [select for diffs]
Added Tue Aug 10 18:34:59 2010 UTC (14 years, 8 months ago) by gezelter
File length: 15768 byte(s)

Migrating Sutton-Chen from Fortran over to C++

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