MADNESS
0.10.1
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Functions | |
static double | guess (const coord_3d &r) |
double | iterate_excite (World &world, NonlinearSolver &solver, real_function_3d &V, real_function_3d &psi, real_function_3d &dpsi, double &eps, real_function_3d &ri) |
double | iterate_ground (World &world, NonlinearSolver &solver, real_function_3d &V, real_function_3d &psi, double &eps) |
double | iterate_xy (World &world, real_function_3d &V, real_function_3d &psi, real_function_3d &dpsi, double &eps, real_function_3d &ri, real_function_3d &x, real_function_3d &y, double omega) |
int | main (int argc, char **argv) |
double | rifunction (const coord_3d &r) |
static double | V (const coord_3d &r) |
Variables | |
static const long | k = 6 |
static const double | L = 64.0*R |
static const double | R = 1.4 |
static const double | thresh = 1e-4 |
double iterate_excite | ( | World & | world, |
NonlinearSolver & | solver, | ||
real_function_3d & | V, | ||
real_function_3d & | psi, | ||
real_function_3d & | dpsi, | ||
double & | eps, | ||
real_function_3d & | ri | ||
) |
References madness::BSHOperator3D(), madness::CoulombOperator(), e(), madness::Function< T, NDIM >::norm2(), op(), madness::print(), psi(), madness::World::rank(), madness::Function< T, NDIM >::scale(), madness::Function< T, NDIM >::truncate(), madness::NonlinearSolverND< NDIM >::update(), and V().
Referenced by main().
double iterate_ground | ( | World & | world, |
NonlinearSolver & | solver, | ||
real_function_3d & | V, | ||
real_function_3d & | psi, | ||
double & | eps | ||
) |
References madness::BSHOperator3D(), e(), madness::inner(), madness::detail::norm(), madness::Function< T, NDIM >::norm2(), op(), madness::print(), psi(), madness::World::rank(), madness::Function< T, NDIM >::scale(), madness::Function< T, NDIM >::truncate(), madness::NonlinearSolverND< NDIM >::update(), and V().
Referenced by main().
double iterate_xy | ( | World & | world, |
real_function_3d & | V, | ||
real_function_3d & | psi, | ||
real_function_3d & | dpsi, | ||
double & | eps, | ||
real_function_3d & | ri, | ||
real_function_3d & | x, | ||
real_function_3d & | y, | ||
double | omega | ||
) |
int main | ( | int | argc, |
char ** | argv | ||
) |
References axis, SafeMPI::COMM_WORLD, madness::CoulombOperator(), e(), e1(), madness::WorldGopInterface::fence(), madness::finalize(), madness::World::gop, guess(), madness::initialize(), madness::inner(), iterate_excite(), iterate_ground(), iterate_xy(), k, L, omega, op(), potential(), madness::print(), psi(), R, madness::World::rank(), rifunction(), madness::FunctionDefaults< NDIM >::set_cubic_cell(), madness::FunctionDefaults< NDIM >::set_initial_level(), madness::FunctionDefaults< NDIM >::set_k(), madness::FunctionDefaults< NDIM >::set_refine(), madness::FunctionDefaults< NDIM >::set_thresh(), madness::FunctionDefaults< NDIM >::set_truncate_mode(), madness::square(), madness::startup(), thresh, and V().
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static |
Referenced by iterate_excite(), iterate_ground(), iterate_xy(), and main().
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static |
Referenced by main().