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Revision 169 - Directory Listing - [select for diffs]
Modified Fri Nov 8 20:05:44 2002 UTC (22 years, 6 months ago) by chuckv
Diff to previous 168
MPI Force rewrite in progress...

Revision 168 - Directory Listing - [select for diffs]
Modified Fri Nov 8 15:01:43 2002 UTC (22 years, 6 months ago) by chuckv
Diff to previous 167
Initial commit of mpi routines for force decomposition.

Revision 167 - Directory Listing - [select for diffs]
Modified Fri Nov 8 14:21:52 2002 UTC (22 years, 6 months ago) by chuckv
Diff to previous 162
First commit of mpi force code.

Revision 162 - Directory Listing - [select for diffs]
Modified Thu Oct 31 21:20:49 2002 UTC (22 years, 6 months ago) by mmeineke
Diff to previous 134
*** empty log message ***

Revision 134 - Directory Listing - [select for diffs]
Modified Fri Oct 11 15:09:09 2002 UTC (22 years, 6 months ago) by chuckv
Diff to previous 131
*** empty log message ***

Revision 131 - Directory Listing - [select for diffs]
Modified Wed Oct 9 22:29:40 2002 UTC (22 years, 7 months ago) by chuckv
Diff to previous 126
*** empty log message ***

Revision 126 - Directory Listing - [select for diffs]
Modified Thu Oct 3 20:12:15 2002 UTC (22 years, 7 months ago) by chuckv
Diff to previous 117
Added make include.

Revision 117 - Directory Listing - [select for diffs]
Modified Tue Sep 24 22:10:55 2002 UTC (22 years, 7 months ago) by mmeineke
Diff to previous 114
fixed allot of warnings, and adde the molecule

Revision 114 - Directory Listing - [select for diffs]
Modified Mon Sep 23 15:13:10 2002 UTC (22 years, 7 months ago) by mmeineke
Diff to previous 31
starting work on the molecule class

starting to add in the molecule class


adding in the molecule class

Revision 31 - Directory Listing - [select for diffs]
Modified Tue Jul 16 21:38:22 2002 UTC (22 years, 9 months ago) by mmeineke
Diff to previous 30
fixed a bug in getA( double the_A[3][3] );

Revision 30 - Directory Listing - [select for diffs]
Modified Tue Jul 16 21:10:49 2002 UTC (22 years, 9 months ago) by mmeineke
Diff to previous 25
added the getA( double the_A[3][3] ) routine to the Directional Atom Class, to facilitate easier RotMat aquisition

Revision 25 - Directory Listing - [select for diffs]
Modified Tue Jul 9 21:46:32 2002 UTC (22 years, 10 months ago) by mmeineke
Diff to previous 11
fixed a precision error in the calculation of the temperature.
Also fixed the order that dump file are written.

Revision 11 - Directory Listing - [select for diffs]
Added Tue Jul 9 18:40:59 2002 UTC (22 years, 10 months ago) by mmeineke
This commit was generated by cvs2svn to compensate for changes in r10, which
included commits to RCS files with non-trunk default branches.

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