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q3::NormConservingPlanewaveWavefunctionInitializer Member List

This is the complete list of members for q3::NormConservingPlanewaveWavefunctionInitializer, including all inherited members.

compute_atomic_wavefunctions(int kpoint_index, int number_of_plane_waves, int number_of_bands, const std::vector< int > &g_vector_indices, const Crystal &crystal_structure, const KPointsGrid &kpoint_grid, const PlanewaveBasis &planewave_basis, const PseudopotentialSet &pseudopotential_set, std::vector< std::vector< Complex > > &atomic_wavefunctions)q3::NormConservingPlanewaveWavefunctionInitializerinline
initialize_interpolation_table(const PseudopotentialSet &pseudopotential_set, Real cell_volume)q3::NormConservingPlanewaveWavefunctionInitializerinline
rotate_wavefunctions(int kpoint_index, int kpoint_index_state, int number_of_plane_waves, int number_of_bands, const std::vector< int > &g_vector_indices, const std::vector< Real > &kinetic_energy_squared, const std::vector< Real > &smooth_potential, const Crystal &crystal_structure, const KPointsGrid &kpoint_grid, const PlanewaveBasis &planewave_basis, const execution::PlanewaveExecutionPolicy &execution_policy, const NormConservingPlanewaveKohnShamQuantumSystem &pseudopotential_quantum_system, const std::vector< std::vector< Complex > > &atomic_wavefunctions, PlanewaveKohnShamQuantumSystem &quantum_system, const Matrix< Complex > &precomputed_kleinman_bylander_potential)q3::NormConservingPlanewaveWavefunctionInitializerinline