PNOStructures.h File Reference

#include <valarray>
#include <string>
#include <madness/chem/PNOParameters.h>
#include <madness/chem/PNOTensors.h>
#include <madness/world/madness_exception.h>
#include <madness.h>
#include <madness/chem/nemo.h>

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Classes
struct	madness::CISData
	POD for CIS excitation. More...
struct	madness::ElectronPairIterator
struct	madness::PNOPairs::MemInfo
struct	madness::MyTimer
	Timer structure. More...
struct	madness::OrbitalIterator
	iterates the third index for pair coupling More...
struct	madness::PairEnergies
	POD structure for energies. More...
class	madness::ParametrizedExchange
struct	madness::PNOPairs
	POD for PNO code. More...
struct	madness::valarray_allocator

Namespaces
namespace	madness
	Namespace for all elements and tools of MADNESS.

Functions
double	madness::inner (const std::valarray< double > &bra, const std::valarray< double > &ket)
	inner product for std::valarray