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SIRIUS 7.5.0
Electronic structure library and applications
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This is the complete list of members for sirius::XC_functional, including all inherited members.
| family() const (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| get_gga(const int size, const double *rho, const double *sigma, double *vrho, double *vsigma, double *e) const | sirius::XC_functional_base | inline |
| get_gga(const int size, const double *rho_up, const double *rho_dn, const double *sigma_uu, const double *sigma_ud, const double *sigma_dd, double *vrho_up, double *vrho_dn, double *vsigma_uu, double *vsigma_ud, double *vsigma_dd, double *e) const | sirius::XC_functional_base | inline |
| get_lda(const int size, const double *rho, double *v, double *e) const | sirius::XC_functional_base | inline |
| get_lda(const int size, const double *rho_up, const double *rho_dn, double *v_up, double *v_dn, double *e) const | sirius::XC_functional_base | inline |
| handler() (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| handler_ (defined in sirius::XC_functional_base) | sirius::XC_functional_base | protected |
| is_correlation() const (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| is_exchange() const (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| is_exchange_correlation() const (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| is_gga() const (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| is_lda() const (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| is_vdw() const (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| kind() const (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| libxc_initialized_ (defined in sirius::XC_functional_base) | sirius::XC_functional_base | protected |
| libxc_name_ (defined in sirius::XC_functional_base) | sirius::XC_functional_base | protected |
| name() const (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| num_spins_ (defined in sirius::XC_functional_base) | sirius::XC_functional_base | protected |
| operator=(const XC_functional &src)=delete (defined in sirius::XC_functional) | sirius::XC_functional | private |
| refs() const (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| set_dens_threshold(double tre) | sirius::XC_functional_base | inline |
| vdw_update_unit_cell(spfft::Transform const &fft__, r3::matrix< double > const &lattice_vectors__) (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| XC_functional(const XC_functional &src)=delete (defined in sirius::XC_functional) | sirius::XC_functional | private |
| XC_functional(spfft::Transform const &fft__, r3::matrix< double > const &lattice_vectors__, const std::string libxc_name__, int num_spins__) (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| XC_functional(XC_functional &&src__) (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| XC_functional_base(const XC_functional_base &src)=delete (defined in sirius::XC_functional_base) | sirius::XC_functional_base | private |
| XC_functional_base(const std::string libxc_name__, int num_spins__) (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| XC_functional_base(XC_functional_base &&src__) (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
| ~XC_functional() (defined in sirius::XC_functional) | sirius::XC_functional | inline |
| ~XC_functional_base() (defined in sirius::XC_functional_base) | sirius::XC_functional_base | inline |
1.9.3