wavefunction_atomic.hpp File Reference

#include <algorithm>
#include <cmath>
#include <vector>
#include "layer_0_core/math/integration/simpson.hpp"
#include "layer_0_core/math/spherical/bessel.hpp"
#include "layer_0_core/math/tolerances.hpp"
#include "layer_0_core/types/init.hpp"
#include "layer_3_representation/pseudopotential/set.hpp"

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Namespaces
namespace	q3

Functions
std::vector< std::vector< std::vector< Real > > >	q3::tabulate_atomic_wavefunctions_in_q_space (const PseudopotentialSet &pseudopotential_set, Real cell_volume, Real q_spacing, int number_of_q_points)