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: 13231 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.

updated copyright notices

Revision 1629 - (view) (annotate) - [select for diffs]
Modified Wed Sep 14 21:15:17 2011 UTC (13 years, 7 months ago) by gezelter
File length: 15826 byte(s)
Diff to previous 1586

Merging changes from old branch into development branch

bug fixes

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: 15635 byte(s)
Diff to previous 1575

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

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: 15589 byte(s)
Diff to previous 1554

Added Atypes to new C++ force decomposition.

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: 15465 byte(s)
Diff to previous 1545

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

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: 15417 byte(s)
Diff to previous 1505

compiles, builds and runs, but is very slow

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: 14915 byte(s)
Diff to previous 1482

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

Fixed a bug in EAM.  Seems to work now!

Revision 1481 - (view) (annotate) - [select for diffs]
Modified Mon Jul 26 21:55:18 2010 UTC (14 years, 9 months ago) by gezelter
File length: 19085 byte(s)
Diff to previous 1480

fixed phi mixing

no longer segfaults

Revision 1479 - (view) (annotate) - [select for diffs]
Modified Mon Jul 26 19:00:48 2010 UTC (14 years, 9 months ago) by gezelter
File length: 18772 byte(s)
Diff to previous 1478

Added EAM.  Still segfaults but compiles.

busticated EAM