Revision 1871 - Directory Listing - [select for diffs]
Modified Fri May 10 14:59:13 2013 UTC (11 years, 11 months ago) by gezelter
Diff to previous 1870

Bugs in the FQ samples, fixed for Dump2XYZ to print out charges and electric fields

Chasing down bugs in the TIP4P_FQ model.

Revision 1766 - Directory Listing - [select for diffs]
Modified Thu Jul 5 17:08:25 2012 UTC (12 years, 10 months ago) by gezelter
Diff to previous 1761

Added Fluctuating Charge Langevin propagator, and made it the default
fixed some errors on the one-center slater coulomb integrals, and some
parameters in PhysicalConstants.

fixes for fluctuating charges

Revision 1751 - Directory Listing - [select for diffs]
Added Thu Jun 7 14:10:44 2012 UTC (12 years, 10 months ago) by gezelter

Adding Joseph's FlucQ samples for testing