| 1 | #include <cstring> | 
| 2 | #include <iostream> | 
| 3 | #include <fstream> | 
| 4 |  | 
| 5 | #include "ReadWrite.hpp" | 
| 6 | #include "simError.h" | 
| 7 |  | 
| 8 |  | 
| 9 | StatWriter::StatWriter( SimInfo* the_entry_plug ){ | 
| 10 |  | 
| 11 | entry_plug = the_entry_plug; | 
| 12 |  | 
| 13 | strcpy( outName, entry_plug->statusName ); | 
| 14 | outFile.open(outName, ios::out | ios::trunc ); | 
| 15 |  | 
| 16 | if( !outFile ){ | 
| 17 |  | 
| 18 | sprintf( painCave.errMsg, | 
| 19 | "Could not open \"%s\" for stat output.\n", | 
| 20 | outName); | 
| 21 | painCave.isFatal = 1; | 
| 22 | simError(); | 
| 23 | } | 
| 24 |  | 
| 25 | //outFile.setf( ios::scientific ); | 
| 26 | outFile << "#time(fs)\ttot_E\tpotential\tkinetic\ttemperature\n"; | 
| 27 |  | 
| 28 | tStats = new Thermo( entry_plug ); | 
| 29 | } | 
| 30 |  | 
| 31 | StatWriter::~StatWriter( ){ | 
| 32 |  | 
| 33 | outFile.close(); | 
| 34 | delete tStats; | 
| 35 | } | 
| 36 |  | 
| 37 | void StatWriter::writeStat( double currentTime ){ | 
| 38 |  | 
| 39 | outFile.precision(8); | 
| 40 | outFile | 
| 41 | << currentTime << "\t" | 
| 42 | << tStats->getTotalE() << "\t" | 
| 43 | << tStats->getPotential() << "\t" | 
| 44 | << tStats->getKinetic() << "\t" | 
| 45 | << tStats->getTemperature() << "\n"; | 
| 46 | outFile.flush(); | 
| 47 | } |