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root/group/trunk/OOPSE/samples/water/ssd.bass
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Comparing trunk/OOPSE/samples/water/ssd.bass (file contents):
Revision 851 by mmeineke, Wed Nov 5 19:18:17 2003 UTC vs.
Revision 905 by tim, Wed Jan 7 19:26:12 2004 UTC

# Line 8 | Line 8 | ensemble = NPTf;
8  
9   initialConfig = "./init_ssd.eor";
10  
11 < ensemble = NPTf;
11 > ensemble = NVE;
12   forceField = "DUFF";
13   useReactionField = "false";
14   dielectric = 80.0;
# Line 24 | Line 24 | runTime = 2e6;
24   tauBarostat = 1e4;
25  
26   dt = 2.0;
27 < runTime = 2e6;
27 > runTime = 1e2;
28  
29 < sampleTime = 1e3;
29 > sampleTime = 1;
30   statusTime = 2;

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