config.h File Reference

This graph shows which files directly or indirectly include this file:

Go to the source code of this file.

Defines

#define DEV_SCF_CLASS_NO_MEMORY   1
#define F77_FUNC(name, NAME)   name ## _
#define F77_FUNC_(name, NAME)   name ## _
#define HAVE_INTTYPES_H   1
#define HAVE_MEMORY_H   1
#define HAVE_MEMSET   1
#define HAVE_MPI   1
#define HAVE_NAMESPACES
#define HAVE_STDINT_H   1
#define HAVE_STDLIB_H   1
#define HAVE_STL
#define HAVE_STRING_H   1
#define HAVE_STRINGS_H   1
#define HAVE_SYS_STAT_H   1
#define HAVE_SYS_TYPES_H   1
#define HAVE_UNISTD_H   1
#define PACKAGE   "QC++"
#define PACKAGE_BUGREPORT   ""
#define PACKAGE_NAME   ""
#define PACKAGE_STRING   ""
#define PACKAGE_TARNAME   ""
#define PACKAGE_VERSION   ""
#define QCPP_DATABASE_PATH_   "/home/coulaud/build/QCPP/seq/noblas/share"
#define QCRestrict   __restrict__
#define STDC_HEADERS   1
#define USE_LAPACK   1
#define VERSION   "2.5.4"


Define Documentation

#define DEV_SCF_CLASS_NO_MEMORY   1
 

Definition at line 5 of file config.h.

#define F77_FUNC name,
NAME   )     name ## _
 

Definition at line 13 of file config.h.

#define F77_FUNC_ name,
NAME   )     name ## _
 

Definition at line 16 of file config.h.

#define HAVE_INTTYPES_H   1
 

Definition at line 25 of file config.h.

#define HAVE_MEMORY_H   1
 

Definition at line 31 of file config.h.

#define HAVE_MEMSET   1
 

Definition at line 34 of file config.h.

#define HAVE_MPI   1
 

Definition at line 37 of file config.h.

#define HAVE_NAMESPACES
 

Definition at line 40 of file config.h.

#define HAVE_STDINT_H   1
 

Definition at line 43 of file config.h.

#define HAVE_STDLIB_H   1
 

Definition at line 46 of file config.h.

#define HAVE_STL
 

Definition at line 49 of file config.h.

#define HAVE_STRING_H   1
 

Definition at line 55 of file config.h.

#define HAVE_STRINGS_H   1
 

Definition at line 52 of file config.h.

#define HAVE_SYS_STAT_H   1
 

Definition at line 58 of file config.h.

#define HAVE_SYS_TYPES_H   1
 

Definition at line 61 of file config.h.

#define HAVE_UNISTD_H   1
 

Definition at line 64 of file config.h.

#define PACKAGE   "QC++"
 

Definition at line 67 of file config.h.

Referenced by QCKimikaPartitioner< TPSystem >::extractDomains(), and QCKimikaPartitioner< TPSystem >::writeInventorFiles().

#define PACKAGE_BUGREPORT   ""
 

Definition at line 70 of file config.h.

#define PACKAGE_NAME   ""
 

Definition at line 73 of file config.h.

#define PACKAGE_STRING   ""
 

Definition at line 76 of file config.h.

#define PACKAGE_TARNAME   ""
 

Definition at line 79 of file config.h.

#define PACKAGE_VERSION   ""
 

Definition at line 82 of file config.h.

#define QCPP_DATABASE_PATH_   "/home/coulaud/build/QCPP/seq/noblas/share"
 

Definition at line 85 of file config.h.

Referenced by main(), and usage().

#define QCRestrict   __restrict__
 

Definition at line 89 of file config.h.

Referenced by QCMDSystem< TPSolver >::adjustFermiEnergyNew(), QCModelMatrices::buildMatrices(), QCMDSystem< TPSolver >::completeDensityMatrices(), QCHamiltonGtr< TPMatrix >::completeElems(), QCFockGtr< TPMatrix >::completeElems(), QCMDSystem< TPSolver >::completeFockMatricesAndElecEnergy(), QCMDSystem< TPSolver >::completeHamiltonMatrices(), QCSubDomain::computeBFactor(), QCMndo::computeCoreEnergy(), QCOverlapGtr< TPMatrix >::computeDerivatives(), QCOverlapGtr< TPMatrix >::computeElems(), QCHamiltonGtr< TPMatrix >::computeElems(), QCDensityGtr< TPMatrix >::computeElems(), QCDensityGtr< TPMatrix >::computeElemsDC(), QCGlobalSystem< TPSolver >::computeEnergyDerivatives(), QCMndo::deriveCoreEnergy(), QCMndo::deriveElecEnergy(), QCFockGtr< TPMatrix >::diagonalize(), QCSubDomain::fillDensityArray(), QCOverlapGtr< TPMatrix >::FillExpHalfVector(), QCSCFAlgo::fixPoint(), QCDCAlgo::fixPoint(), QCDensityGtr< TPMatrix >::initDiag(), QCSubDomain::initWeightedDensity(), QCFockGtr< TPMatrix >::levelShifting(), QCDensityGtr< TPMatrix >::mergeDensity(), QCSCFAlgo::optimalDamping(), QCDCAlgo::optimalDamping(), QCKimikaPartitioner< TPSystem >::partitioning(), QCGlobalSystem< TPSolver >::readDensityFromFileAscii(), QCGlobalSystem< TPSolver >::readDensityFromFileBinary(), QCMDSystem< TPSolver >::readDistDensityFromFileAscii(), QCMDSystem< TPSolver >::readSharedDensityFromFileAscii(), QCKimikaPartitioner< TPSystem >::setAtomsInBuffersDixon(), QCKimikaPartitioner< TPSystem >::setAtomsInBuffersStd(), QCMatrix::swap(), QCSubDomain::traceProductCoreShell1(), QCMDSystem< TPSolver >::writeDensityOnFileAscii(), QCGlobalSystem< TPSolver >::writeDensityOnFileAscii(), QCGlobalSystem< TPSolver >::writeDensityOnFileBinary(), QCTrace::writeEigenValue(), QCTrace::writeEigenValuesAndEigenVectors(), QCMDSystem< TPSolver >::writeLocalDensityOnFilesAscii(), and QCMDSystem< TPSolver >::writeOrbitalPartition().

#define STDC_HEADERS   1
 

Definition at line 95 of file config.h.

#define USE_LAPACK   1
 

Definition at line 98 of file config.h.

#define VERSION   "2.5.4"
 

Definition at line 101 of file config.h.

Referenced by QCKimikaPartitioner< TPSystem >::extractDomains(), and QCKimikaPartitioner< TPSystem >::writeInventorFiles().


Generated on Sat Jan 28 21:07:30 2006 for QC++ by  doxygen 1.4.4