Revision 2060 - Directory Listing - [select for diffs]
Modified Tue Mar 3 16:19:47 2015 UTC (10 years, 8 months ago) by gezelter
Diff to previous 2047

Got rid of unused variables and spurious warnings

Added UniformGradient to perturbation list.

Revision 2046 - Directory Listing - [select for diffs]
Modified Tue Dec 2 22:11:04 2014 UTC (10 years, 11 months ago) by gezelter
Diff to previous 2034

Fixed some broken comments for use with Doxygen.
Made changes to allow topology-based force-field overrides in include files.
Fixed a calculation of box quadrupole moments for molecules with point dipoles.

Updating UniformGradient to the new parameter structure (two unit vectors
and a gradient strength).

Revision 2026 - Directory Listing - [select for diffs]
Modified Wed Oct 22 12:23:59 2014 UTC (11 years ago) by gezelter
Diff to previous 2022

Starting to add support for UniformGradient. 
Changed Vector3d input type to a more general std::vector<RealType> input.  This change alters RNEMD and UniformField inputs.

Added support for accumulateBoxQuadrupole flag

Revision 2020 - Directory Listing - [select for diffs]
Modified Mon Sep 22 19:18:35 2014 UTC (11 years, 1 month ago) by gezelter
Diff to previous 1987

Fixes for restraints, renaming of UniformField

Removing vestiges of deprecated MPI:: namespace C++ MPI bindings

Revision 1908 - Directory Listing - [select for diffs]
Modified Fri Jul 19 21:25:45 2013 UTC (12 years, 3 months ago) by gezelter
Diff to previous 1879

Added infrastructure for region-constrained fluctuating charges.

MERGE OpenMD development 1783:1878 into trunk

Revision 1782 - Directory Listing - [select for diffs]
Modified Wed Aug 22 02:28:28 2012 UTC (13 years, 2 months ago) by gezelter
Copied from: branches/development/src/perturbations revision 1781
Diff to previous 1780

MERGE OpenMD development branch 1465:1781 into trunk

Adding an electric field and the architecture for external perturbations.   Fixing a bug in MultipoleAtomTypesSectionParser.