[ViewVC] Diff of: OpenMD/trunk/src/applications/staticProps/StaticProps.cpp

Comparing trunk/src/applications/staticProps/StaticProps.cpp (file contents):
Revision 335 by tim, Sun Feb 13 20:05:42 2005 UTC vs.
Revision 336 by tim, Mon Feb 14 18:51:48 2005 UTC

#	Line 111 \| Line 111 \| *int main(int argc, char argv[]){**
111
112		//parse md file and set up the system
113		SimCreator creator;
114	<	SimInfo* info = creator.createSim(mdFileName, false);
114	>	SimInfo* info = creator.createSim(mdFileName);
115
116		double maxLen;
117		if (args_info.length_given) {
118		maxLen = args_info.length_arg;
119		} else {
120	<	double rcut;
121	<	double rsw;
122	<	info->getCutoff(rcut, rsw);
123	<	maxLen = rcut + rsw;
120	>	Mat3x3d hmat = info->getSnapshotManager()->getCurrentSnapshot()->getHmat();
121	>	maxLen = std::min(std::min(hmat(0, 0), hmat(1, 1)), hmat(2, 2)) /2.0;
122		}
123
124

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