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Revision 219 - Directory Listing - [select for diffs]
Modified Sun Dec 29 19:12:06 2002 UTC (21 years, 6 months ago) by chuckv
Diff to previous 218
Added classes to handle random number generation.

Revision 218 - Directory Listing - [select for diffs]
Modified Sun Dec 29 19:11:05 2002 UTC (21 years, 6 months ago) by chuckv
Diff to previous 216
Changed thermo getKinetic and getPotential for MPI.
Added header for SPRNG random number generator class.

Revision 216 - Directory Listing - [select for diffs]
Modified Sun Dec 29 16:43:11 2002 UTC (21 years, 6 months ago) by chuckv
Diff to previous 215
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Revision 215 - Directory Listing - [select for diffs]
Modified Thu Dec 19 21:59:51 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 214
+ added lennard-jones force module and corresponding class.
+ created forceFactory directory.

Revision 214 - Directory Listing - [select for diffs]
Modified Mon Dec 16 21:42:14 2002 UTC (21 years, 7 months ago) by mmeineke
Diff to previous 212
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Revision 212 - Directory Listing - [select for diffs]
Modified Fri Dec 13 21:17:00 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 211
Added mpi to InitializeFromFile read in.

Revision 211 - Directory Listing - [select for diffs]
Modified Fri Dec 13 19:15:57 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 210
Added replan of gather-scatter routines for future load balancing.

Revision 210 - Directory Listing - [select for diffs]
Modified Fri Dec 13 18:06:58 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 209
Finished updating mpiSimulation to work with c++.

Revision 209 - Directory Listing - [select for diffs]
Modified Fri Dec 13 17:59:52 2002 UTC (21 years, 7 months ago) by mmeineke
Diff to previous 207
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Revision 207 - Directory Listing - [select for diffs]
Modified Fri Dec 13 16:51:23 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 206
Changed name of mpi_force_module to mpiSimulation to match with C++ code.

Revision 206 - Directory Listing - [select for diffs]
Modified Thu Dec 12 21:21:59 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 203
Initial mpi io conversion.

Revision 203 - Directory Listing - [select for diffs]
Modified Tue Dec 10 22:09:44 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 194
Added mpiComponentPlan.h a dual fortran c header file defining mpi
simulation parameters for both c and fortran.

Revision 194 - Directory Listing - [select for diffs]
Modified Wed Dec 4 21:19:38 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 191
First addition of mpiDivideLabor to split mpi simulation among processors.

Revision 191 - Directory Listing - [select for diffs]
Modified Mon Dec 2 19:12:42 2002 UTC (21 years, 7 months ago) by chuckv
Diff to previous 189
Addition of c wrapper header for for fortran module proceedures.

Revision 189 - Directory Listing - [select for diffs]
Modified Tue Nov 26 21:04:43 2002 UTC (21 years, 7 months ago) by mmeineke
Diff to previous 185
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Revision 185 - Directory Listing - [select for diffs]
Modified Fri Nov 22 20:39:33 2002 UTC (21 years, 8 months ago) by chuckv
Diff to previous 184
Initial commit of wrappers for fortran module proceedures.

Revision 184 - Directory Listing - [select for diffs]
Modified Thu Nov 21 20:33:06 2002 UTC (21 years, 8 months ago) by mmeineke
Diff to previous 178
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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 174 - Directory Listing - [select for diffs]
Modified Mon Nov 11 22:35:41 2002 UTC (21 years, 8 months ago) by chuckv
Diff to previous 169
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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...

Revision 168 - Directory Listing - [select for diffs]
Modified Fri Nov 8 15:01:43 2002 UTC (21 years, 8 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 (21 years, 8 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 (21 years, 8 months ago) by mmeineke
Diff to previous 134
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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 131 - Directory Listing - [select for diffs]
Modified Wed Oct 9 22:29:40 2002 UTC (21 years, 9 months ago) by chuckv
Diff to previous 126
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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.

Revision 117 - Directory Listing - [select for diffs]
Modified Tue Sep 24 22:10:55 2002 UTC (21 years, 9 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 (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

Revision 31 - Directory Listing - [select for diffs]
Modified Tue Jul 16 21:38:22 2002 UTC (22 years 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 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 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 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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