ViewVC Help
View File | Revision Log | Show Annotations | View Changeset | Root Listing
root/group/trunk/OOPSE/libmdtools/StatWriter.cpp
(Generate patch)

Comparing trunk/OOPSE/libmdtools/StatWriter.cpp (file contents):
Revision 1180 by chrisfen, Thu May 20 20:24:07 2004 UTC vs.
Revision 1187 by chrisfen, Sat May 22 18:16:18 2004 UTC

# Line 32 | Line 32 | StatWriter::StatWriter( SimInfo* the_entry_plug ){
32        painCave.isFatal = 1;
33        simError();
34      }
35 –    
36 –    rawFile.open(rawName, ios::out | ios::trunc );
37 –    
38 –    if( !rawFile ){
39 –      
40 –      sprintf( painCave.errMsg,
41 –               "Could not open \"%s\" for stat output.\n",
42 –               rawName);
43 –      painCave.isFatal = 1;
44 –      simError();
45 –    }
35  
36      //outFile.setf( ios::scientific );
37      outFile << "#time(fs)\ttot_E\tpotential\tkinetic\ttemperature\tpressure\tvolume\tconserved quantity\n";
38      
39 <    rawFile << "#time(fs)\tRaw Pot\t Raw Harm\n";
39 >    if (entry_plug->useThermInt) {
40 >      rawFile.open(rawName, ios::out | ios::trunc );
41 >      
42 >      if( !rawFile ){
43 >        
44 >        sprintf( painCave.errMsg,
45 >                 "Could not open \"%s\" for stat output.\n",
46 >                 rawName);
47 >        painCave.isFatal = 1;
48 >        simError();
49 >      }
50 >      
51 >      rawFile << "#time(fs)\tRaw Pot\t Raw Harm\n";
52 >    }
53  
54   #ifdef IS_MPI
55    }

Diff Legend

– Removed lines
+ Added lines
< Changed lines
> Changed lines