[ViewVC] Log of: OpenMD/branches/development/src/io/GayBerneAtomTypesSectionParser.hpp

Revision 1850 - (view) (annotate) - [select for diffs]
Modified Wed Feb 20 15:39:39 2013 UTC (12 years, 9 months ago) by gezelter
File length: 2720 byte(s)
Diff to previous 1710

Fixed a widespread typo in the license

Revision 1710 - (view) (annotate) - [select for diffs]
Modified Fri May 18 21:44:02 2012 UTC (13 years, 7 months ago) by gezelter
File length: 2719 byte(s)
Diff to previous 1688

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 1688 - (view) (annotate) - [select for diffs]
Modified Wed Mar 14 17:56:01 2012 UTC (13 years, 9 months ago) by gezelter
File length: 2760 byte(s)
Diff to previous 1665

Bug fixes for GB.  Now using strength parameter mixing ideas from Wu
et al. [J. Chem. Phys. 135, 155104 (2011)].  This helps get the
dissimilar particle mixing behavior to be the same whichever order the
two particles come in.  This does require that the force field file to
specify explicitly the values for epsilon in the cross (X), side-by-side (S), 
and end-to-end (E) configurations.

Revision 1665 - (view) (annotate) - [select for diffs]
Modified Tue Nov 22 20:38:56 2011 UTC (14 years ago) by gezelter
File length: 2890 byte(s)
Diff to previous 1465

updated copyright notices

Revision 1465 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 23:08:25 2010 UTC (15 years, 5 months ago) by chuckv
File length: 2824 byte(s)
Diff to previous 1442

Creating busticated version of OpenMD

Revision 1442 - (view) (annotate) - [select for diffs]
Modified Mon May 10 17:28:26 2010 UTC (15 years, 7 months ago) by gezelter
Original Path: trunk/src/io/GayBerneAtomTypesSectionParser.hpp
File length: 2824 byte(s)
Diff to previous 1390

Adding property set to svn entries

Revision 1390 - (view) (annotate) - [select for diffs]
Modified Wed Nov 25 20:02:06 2009 UTC (16 years ago) by gezelter
Original Path: trunk/src/io/GayBerneAtomTypesSectionParser.hpp
File length: 2824 byte(s)
Diff to previous 981

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

Revision 981 - (view) (annotate) - [select for diffs]
Modified Mon Jun 5 18:24:45 2006 UTC (19 years, 6 months ago) by gezelter
Original Path: trunk/src/io/GayBerneAtomTypesSectionParser.hpp
File length: 2781 byte(s)
Diff to previous 802

Massive changes for GB code with multiple ellipsoid types (a la
Cleaver's paper).

Also, changes in hydrodynamics code to make HydroProp a somewhat
smarter class (rather than just a struct).

Revision 802 - (view) (annotate) - [select for diffs]
Modified Thu Dec 8 15:38:49 2005 UTC (20 years ago) by chuckv
Original Path: trunk/src/io/GayBerneAtomTypesSectionParser.hpp
File length: 3203 byte(s)
Diff to previous 530

Wow thats alot o' files. Now passing forceFieldOptions to all of the parsers.

Revision 530 - (view) (annotate) - [select for diffs]
Added Tue May 17 03:46:45 2005 UTC (20 years, 7 months ago) by kdaily
Original Path: trunk/src/io/GayBerneAtomTypesSectionParser.hpp
File length: 3155 byte(s)

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