q3::ChargeCore Struct Reference

Core charge density ρ_core(r) from a pseudopotential (NLCC). More...

#include <charge_core.hpp>

Public Attributes
std::vector< Real >	radial_values

Detailed Description

Core charge density ρ_core(r) from a pseudopotential (NLCC).

Definition at line 18 of file charge_core.hpp.

Member Data Documentation

radial_values

std::vector<Real> q3::ChargeCore::radial_values

Definition at line 19 of file charge_core.hpp.

Referenced by q3::calculate_core_charge_density_at_q(), q3::calculate_core_charge_density_derivative(), and q3::paw_validation::integrated_all_electron_core_charge().

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The documentation for this struct was generated from the following file:

• src/layer_3_representation/pseudopotential/internal/charge_core.hpp