pseudopotential::upf1 Member List

This is the complete list of members for pseudopotential::upf1, including all inherited members.

anygrid(bool uniform_grid)	pseudopotential::anygrid	inline
atomic_number() const	pseudopotential::upf1	inlinevirtual
beta(int index, int &l, std::vector< double > &proj) const	pseudopotential::base	inlinevirtual
buffer_	pseudopotential::upf1	private
correlation() const	pseudopotential::upf1	inlinevirtual
d_ij(int l, int i, int j) const	pseudopotential::upf	inlinevirtual
d_ij(int l, int i, int j)	pseudopotential::upf	inlineprotected
density(std::vector< double > &val) const	pseudopotential::upf1	inlinevirtual
description() const	pseudopotential::upf1	inlinevirtual
dij_	pseudopotential::upf	protected
dnm_zero(int nbeta, std::vector< std::vector< double > > &dnm) const	pseudopotential::base	inlinevirtual
doc_	pseudopotential::upf1	private
exchange() const	pseudopotential::upf1	inlinevirtual
extrapolate_first_point(std::vector< double > &function_) const	pseudopotential::upf	inlineprotected
file_	pseudopotential::upf1	private
filename_	pseudopotential::base	protected
format() const	pseudopotential::upf1	inlinevirtual
grid(std::vector< double > &val) const	pseudopotential::anygrid	inlinevirtual
grid_	pseudopotential::anygrid	protected
grid_weights(std::vector< double > &val) const	pseudopotential::anygrid	inlinevirtual
grid_weights_	pseudopotential::anygrid	protected
has_density() const	pseudopotential::upf1	inlinevirtual
has_nlcc() const	pseudopotential::upf1	inlinevirtual
has_radial_function(int l) const	pseudopotential::upf1	inlinevirtual
has_rinner() const	pseudopotential::base	inlinevirtual
has_total_angular_momentum() const	pseudopotential::upf1	inlinevirtual
interpolate(std::vector< double > &function) const	pseudopotential::anygrid	inlineprotected
llocal() const	pseudopotential::upf	inlineprotectedvirtual
llocal_	pseudopotential::upf	protected
lmax() const	pseudopotential::base	inlinevirtual
lmax_	pseudopotential::base	protected
local_potential(std::vector< double > &potential) const	pseudopotential::upf1	inlinevirtual
mass() const	pseudopotential::upf1	inlinevirtual
mesh_size() const	pseudopotential::anygrid	inlinevirtual
mesh_size_	pseudopotential::anygrid	protected
mesh_spacing() const	pseudopotential::anygrid	inlinevirtual
nchannels() const	pseudopotential::upf	inlineprotectedvirtual
nchannels_	pseudopotential::upf	protected
nlcc_density(std::vector< double > &density) const	pseudopotential::upf1	inlinevirtual
nprojectors() const	pseudopotential::upf1	inlinevirtual
nprojectors_	pseudopotential::upf1	private
nprojectors_per_l(int l) const	pseudopotential::upf1	inlinevirtual
nquad() const	pseudopotential::base	inlinevirtual
nwavefunctions() const	pseudopotential::upf1	inlinevirtual
nwavefunctions_	pseudopotential::upf1	private
proj_c_	pseudopotential::upf1	private
proj_l_	pseudopotential::upf1	private
projector(int l, int i, std::vector< double > &proj) const	pseudopotential::upf1	inlinevirtual
projector_2j(int l, int ic) const	pseudopotential::upf1	inlinevirtual
qfcoeff(int index, int ltot, std::vector< double > &val) const	pseudopotential::base	inlinevirtual
qnm(int index, int &l1, int &l2, int &n, int &m, std::vector< double > &val) const	pseudopotential::base	inlinevirtual
radial_function(int l, std::vector< double > &function) const	pseudopotential::upf1	inlinevirtual
radial_potential(int l, std::vector< double > &function) const	pseudopotential::upf1	inlinevirtual
rinner(std::vector< double > &val) const	pseudopotential::base	inlinevirtual
rquad() const	pseudopotential::base	inlinevirtual
size() const	pseudopotential::upf1	inlinevirtual
start_point_	pseudopotential::upf	protected
symbol() const	pseudopotential::upf1	inlinevirtual
symbol_	pseudopotential::upf1	private
type() const	pseudopotential::base	inlinevirtual
type_	pseudopotential::base	protected
uniform_grid_	pseudopotential::anygrid	protected
upf(bool uniform_grid)	pseudopotential::upf	inline
upf1(const std::string &filename, bool uniform_grid=false)	pseudopotential::upf1	inline
valence_charge() const	pseudopotential::upf1	inlinevirtual
value(const rapidxml::xml_base<> *node)	pseudopotential::base	inlineprotectedstatic
wavefunction(int index, int &n, int &l, double &occ, std::vector< double > &proj) const	pseudopotential::upf1	inlinevirtual
wavefunction_2j(int ii) const	pseudopotential::upf1	inlinevirtual
xc_functional_	pseudopotential::upf1	private
zval_	pseudopotential::upf1	private
~base()	pseudopotential::base	inlinevirtual