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Revision 178 - Directory Listing - [select for diffs]
Modified Mon Nov 18 21:24:02 2002 UTC (21 years, 8 months ago) by mmeineke
Diff to previous 174

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Revision 169 - Directory Listing - [select for diffs]
Modified Fri Nov 8 20:05:44 2002 UTC (21 years, 8 months ago) by chuckv
Diff to previous 168

MPI Force rewrite in progress...

Initial commit of mpi routines for force decomposition.

Revision 167 - Directory Listing - [select for diffs]
Modified Fri Nov 8 14:21:52 2002 UTC (21 years, 8 months ago) by chuckv
Diff to previous 162

First commit of mpi force code.

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Revision 134 - Directory Listing - [select for diffs]
Modified Fri Oct 11 15:09:09 2002 UTC (21 years, 9 months ago) by chuckv
Diff to previous 131

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Revision 126 - Directory Listing - [select for diffs]
Modified Thu Oct 3 20:12:15 2002 UTC (21 years, 9 months ago) by chuckv
Diff to previous 117

Added make include.

fixed allot of warnings, and adde the molecule

Revision 114 - Directory Listing - [select for diffs]
Modified Mon Sep 23 15:13:10 2002 UTC (21 years, 10 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

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 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

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 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.