add_quotes(const std::string arg) | madness::QCCalculationParametersBase | inlinestatic |
check_type(const std::string key, const QCParameter ¶meter) | madness::QCCalculationParametersBase | inlinestatic |
check_type_silent(const QCParameter ¶meter) | madness::QCCalculationParametersBase | inlinestatic |
damping_width() const | madness::TDHF::TDHFParameters | inline |
dconv() const | madness::TDHF::TDHFParameters | inline |
debug() const | madness::TDHF::TDHFParameters | inline |
do_oep() const | madness::TDHF::TDHFParameters | inline |
econv() const | madness::TDHF::TDHFParameters | inline |
excitations() const | madness::TDHF::TDHFParameters | inline |
exops() const | madness::TDHF::TDHFParameters | inline |
file_exists(World &world, std::string filename) const | madness::QCCalculationParametersBase | |
freeze() const | madness::TDHF::TDHFParameters | inline |
from_json(const json &j) | madness::QCCalculationParametersBase | inline |
fromstring(const std::string &arg) | madness::QCCalculationParametersBase | inlinestatic |
fromstring(const std::string &arg) | madness::QCCalculationParametersBase | inlinestatic |
get(const std::string key) const | madness::QCCalculationParametersBase | inline |
get_all_parameters() const | madness::QCCalculationParametersBase | inline |
get_ccc_parameters(const double lo) const | madness::TDHF::TDHFParameters | inline |
get_parameter(const std::string key) const | madness::QCCalculationParametersBase | inlineprotected |
get_parameter(const std::string key) | madness::QCCalculationParametersBase | inline |
guess_cm() const | madness::TDHF::TDHFParameters | inline |
guess_dconv() const | madness::TDHF::TDHFParameters | inline |
guess_diag() const | madness::TDHF::TDHFParameters | inline |
guess_econv() const | madness::TDHF::TDHFParameters | inline |
guess_excitation_operators() const | madness::TDHF::TDHFParameters | inline |
guess_excitations() const | madness::TDHF::TDHFParameters | inline |
guess_maxiter() const | madness::TDHF::TDHFParameters | inline |
hash() const | madness::QCCalculationParametersBase | inline |
ignore_unknown_keys | madness::QCCalculationParametersBase | protected |
ignore_unknown_keys_silently | madness::QCCalculationParametersBase | protected |
initialize(const std::string &key, const T &value, const std::string comment="", const std::vector< T > allowed_values={}) | madness::QCCalculationParametersBase | inlineprotected |
initialize_all() | madness::TDHF::TDHFParameters | inline |
irrep() const | madness::TDHF::TDHFParameters | inline |
is_user_defined(std::string key) const | madness::QCCalculationParametersBase | inline |
iterating_excitations() const | madness::TDHF::TDHFParameters | inline |
kain_subspace() const | madness::TDHF::TDHFParameters | inline |
maxiter() const | madness::TDHF::TDHFParameters | inline |
nexcitations() const | madness::TDHF::TDHFParameters | inline |
no_compute() const | madness::TDHF::TDHFParameters | inline |
operator==(const QCCalculationParametersBase &other) const | madness::QCCalculationParametersBase | inline |
overwrite_if_inf(std::string &str, const T &arg) | madness::QCCalculationParametersBase | inlinestatic |
overwrite_if_inf(std::string &str, const T &arg) | madness::QCCalculationParametersBase | inlinestatic |
parameter_exists(const std::string &key) const | madness::QCCalculationParametersBase | inline |
ParameterContainerT typedef | madness::QCCalculationParametersBase | protected |
parameters | madness::QCCalculationParametersBase | protected |
plot() const | madness::TDHF::TDHFParameters | inline |
print(const std::string header="", const std::string footer="") const | madness::QCCalculationParametersBase | |
print_debug | madness::QCCalculationParametersBase | protected |
print_level() const | madness::TDHF::TDHFParameters | inline |
print_to_string(bool non_defaults_only=false) const | madness::QCCalculationParametersBase | |
QCCalculationParametersBase() | madness::QCCalculationParametersBase | inlineprotected |
QCCalculationParametersBase(const QCCalculationParametersBase &other) | madness::QCCalculationParametersBase | inlineprotected |
read_commandline_options(World &world, const commandlineparser &parser, const std::string tag) | madness::QCCalculationParametersBase | private |
read_input(World &world, const std::string filename, const std::string tag) | madness::QCCalculationParametersBase | private |
read_input_and_commandline_options(World &world, const commandlineparser &parser, const std::string tag) | madness::QCCalculationParametersBase | inlineprotectedvirtual |
read_internal(World &world, std::string &filecontents, std::string tag) | madness::QCCalculationParametersBase | virtual |
read_quotes(std::stringstream &ssvalue) | madness::QCCalculationParametersBase | inlinestatic |
read_quotes(std::stringstream &ssvalue) | madness::QCCalculationParametersBase | inlinestatic |
response_kernel() const | madness::TDHF::TDHFParameters | inline |
restart() const | madness::TDHF::TDHFParameters | inline |
serialize(Archive &ar) | madness::QCCalculationParametersBase | inline |
set_derived_value(const std::string &key, const T &value) | madness::QCCalculationParametersBase | inline |
set_derived_values(const std::shared_ptr< SCF > &scf) | madness::TDHF::TDHFParameters | |
set_user_defined_value(const std::string &key, const T &value) | madness::QCCalculationParametersBase | inline |
store_potential() const | madness::TDHF::TDHFParameters | inline |
TDHFParameters() | madness::TDHF::TDHFParameters | inline |
TDHFParameters(const TDHFParameters &other)=default | madness::TDHF::TDHFParameters | |
TDHFParameters(World &world, const commandlineparser &parser) | madness::TDHF::TDHFParameters | inline |
thresh() const | madness::TDHF::TDHFParameters | inline |
throw_if_datagroup_not_found | madness::QCCalculationParametersBase | protected |
to_json() const | madness::QCCalculationParametersBase | inline |
to_json(json &j) const | madness::QCCalculationParametersBase | inline |
tostring(const bool &arg) | madness::QCCalculationParametersBase | inlinestatic |
tostring(const T &arg) | madness::QCCalculationParametersBase | inlinestatic |
trim_blanks(const std::string arg) | madness::QCCalculationParametersBase | inlinestatic |
trim_quotes(const std::string arg) | madness::QCCalculationParametersBase | inlinestatic |
triplet() const | madness::TDHF::TDHFParameters | inline |
try_setting_user_defined_value(const std::string &key, const std::string &val) | madness::QCCalculationParametersBase | inlineprotected |
~QCCalculationParametersBase() | madness::QCCalculationParametersBase | inlineprotectedvirtual |