Revision 1671 - (view) (annotate) - [select for diffs]
Modified Mon Jan 30 21:31:09 2012 UTC (13 years, 4 months ago) by chuckv
File length: 31518 byte(s)
Diff to previous 1670

Adding support for atomic heat flux. Is broken w/ group based cuttoffs.
Units need to be corrected and their may be a sign error in Jv.

Adding experimental branch for calculation of the heatflux based on old version of OpenMD.
This will need to be ported to the development branch later.

Revision 1464 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 19:29:05 2010 UTC (14 years, 10 months ago) by gezelter
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 31530 byte(s)
Diff to previous 1442

removing cruft (atom numbers, do_pot, do_stress) from many modules and
force managers

Adding property set to svn entries

Revision 1390 - (view) (annotate) - [select for diffs]
Modified Wed Nov 25 20:02:06 2009 UTC (15 years, 6 months ago) by gezelter
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 31627 byte(s)
Diff to previous 1346

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

Fixing a parallel bug in the self-self interaction.

Revision 1228 - (view) (annotate) - [select for diffs]
Modified Thu Feb 14 21:37:05 2008 UTC (17 years, 3 months ago) by chuckv
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 30850 byte(s)
Diff to previous 1135

Changes to simparalell to remove MPI stuff.

Removed debug message from simParallel.

Revision 1113 - (view) (annotate) - [select for diffs]
Modified Mon Jan 8 21:29:50 2007 UTC (18 years, 4 months ago) by chuckv
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 30864 byte(s)
Diff to previous 985

Added more error reporting to simParallel.

Fixed a spelling error and a bug in MPI Thermodynamic Integration on file read-in

Revision 962 - (view) (annotate) - [select for diffs]
Modified Wed May 17 19:54:27 2006 UTC (19 years ago) by gezelter
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 30104 byte(s)
Diff to previous 928

Adding single precision capabilities to the fortran side

Added status module to simParallel for error reporting.

Revision 588 - (view) (annotate) - [select for diffs]
Modified Wed Sep 7 22:23:20 2005 UTC (19 years, 8 months ago) by chuckv
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 28940 byte(s)
Diff to previous 507

Added access to mpi logical variables

xemacs has been drafted to perform our indentation services

Revision 264 - (view) (annotate) - [select for diffs]
Modified Fri Jan 14 20:31:16 2005 UTC (20 years, 4 months ago) by gezelter
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 28939 byte(s)
Diff to previous 246

separating modules and C/Fortran interface subroutines

merging new_design branch into OOPSE-2.0

Revision 126 - (view) (annotate) - [select for diffs]
Added Wed Oct 20 21:16:01 2004 UTC (20 years, 7 months ago) by chuckv
Original Path: trunk/src/UseTheForce/DarkSide/simParallel.F90
File length: 27848 byte(s)

Fortran/C++ interface de-obfuscation project appears to be complete!  Woo hoo!