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Commit a2f1d795 authored by Gareth Tribello's avatar Gareth Tribello
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Fixed ClusterDiameter CV

parent 0c874185
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#! FIELDS time size2a dia2a
0.000000 78.0000 2.3294
0.000000 78.0000 1.1541
......@@ -69,8 +69,8 @@ ClusterAnalysisBase(ao)
if( clustr>getNumberOfNodes() ) error("cluster selected is invalid - too few atoms in system");
// Create the task list
for(unsigned i=1;i<getNumberOfNodes();++i){
for(unsigned j=0;j<i;++j) addTaskToList( i*getNumberOfNodes() + j );
for(unsigned i=0;i<getNumberOfNodes();++i){
for(unsigned j=0;j<getNumberOfNodes();++j) addTaskToList( i*getNumberOfNodes() + j );
}
// Now create a higest vessel
addVessel("HIGHEST", "", -1); setupAtomLists();
......
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