MADNESS 0.10.1
|
#include <madness/mra/mra.h>
#include <madness/mra/funcplot.h>
#include "madness/mra/commandlineparser.h"
#include <madness/chem/CalculationParameters.h>
#include <madness/chem/molecule.h>
Functions | |
template<std::size_t NDIM> | |
void | do_plot (World &world, const std::vector< std::string > &filenames, const PlotParameters &pparam) |
int | main (int argc, char **argv) |
void do_plot | ( | World & | world, |
const std::vector< std::string > & | filenames, | ||
const PlotParameters & | pparam | ||
) |
int main | ( | int | argc, |
char ** | argv | ||
) |
References aobasis, madness::filename, madness::finalize(), madness::initialize(), madness::commandlineparser::key_exists(), InputParameters::L, molecule, param, madness::Molecule::print(), madness::QCCalculationParametersBase::print(), madness::print_header2(), madness::World::rank(), madness::FunctionDefaults< NDIM >::set_cubic_cell(), madness::commandlineparser::split(), madness::startup(), and madness::commandlineparser::value().