x_space.h File Reference

#include <madness/mra/mra.h>
#include <madness/tensor/tensor.h>
#include <algorithm>
#include <cstdint>
#include <memory>
#include <numeric>
#include <vector>
#include "molresponse/response_functions.h"

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Classes
struct	madness::response_function_allocator
struct	madness::response_matrix_allocator
struct	madness::X_space
struct	madness::X_vector

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

Functions
auto	madness::create_response_matrix (const size_t &num_states, const size_t &num_orbitals) -> response_matrix
	Create a response matrix object.
auto	madness::to_conjugate_response_matrix (const X_space &x) -> response_matrix
auto	madness::to_conjugate_X_space (const response_matrix &x) -> X_space
	response_matrix [x,y] -> Xspace X.x=y X.y=conjugate(x)
auto	madness::to_flattened_vector (const X_space &x) -> vector_real_function_3d
	Flattens all response functions into a single vector of functions.
auto	madness::to_response_matrix (const X_space &x) -> response_matrix
auto	madness::to_response_vector (const vector_real_function_3d &vec) -> vector_real_function_3d
auto	madness::to_X_space (const response_matrix &x) -> X_space