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root/OpenMD/branches/development/samples/water/dimer/two.md
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Comparing trunk/samples/water/dimer/two.md (file contents):
Revision 2 by gezelter, Fri Sep 24 04:16:43 2004 UTC vs.
Revision 627 by chrisfen, Mon Sep 26 14:27:53 2005 UTC

# Line 10 | Line 10 | ensemble = NVT;
10  
11  
12   ensemble = NVT;
13 < forceField = "WATER";
14 < useReactionField = "false";
13 > forceField = "DUFF";
14 > electrostaticSummationMethod = "none"
15   dielectric = 80.0;
16   cutoffRadius = 9.0;
17   switchingRadius = 7.8;
# Line 27 | Line 27 | runTime = 1e5;
27   dt = 1.0;
28   runTime = 1e5;
29  
30 < sampleTime = 3e4;
31 < statusTime = 1;
30 > sampleTime = 1e2;
31 > statusTime = 10;
32   useInitialTime = "false";
33   useInitialExtendedSystemState = "false";

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