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sc::LYPCFunctional Member List This is the complete list of members for sc::LYPCFunctional, including all inherited members. a0() const (defined in sc::DenFunctional) sc::DenFunctional [inline] a0_ (defined in sc::DenFunctional) sc::DenFunctional [protected] a_ (defined in sc::LYPCFunctional) sc::LYPCFunctional [protected] b_ (defined in sc::LYPCFunctional) sc::LYPCFunctional [protected] c_ (defined in sc::LYPCFunctional) sc::LYPCFunctional [protected] class_desc() const sc::DescribedClass class_name() const sc::DescribedClass class_version() const sc::DescribedClass compute_potential_ (defined in sc::DenFunctional) sc::DenFunctional [protected] d_ (defined in sc::LYPCFunctional) sc::LYPCFunctional [protected] DenFunctional() (defined in sc::DenFunctional) sc::DenFunctional DenFunctional(const Ref< KeyVal > &) (defined in sc::DenFunctional) sc::DenFunctional DenFunctional(StateIn &) (defined in sc::DenFunctional) sc::DenFunctional dereference() sc::RefCount [inline] DescribedClass() (defined in sc::DescribedClass) sc::DescribedClass DescribedClass(const DescribedClass &) (defined in sc::DescribedClass) sc::DescribedClass dir_restore_state(StateIn &si, const char *objectname, const char *keyword=0) (defined in sc::SavableState) sc::SavableState [static] do_fd_point(PointInputData &id, double &in, double &out, double lower_bound, double upper_bound) (defined in sc::DenFunctional) sc::DenFunctional [protected] fd_point(const PointInputData &, PointOutputData &) (defined in sc::DenFunctional) sc::DenFunctional gradient(const PointInputData &, PointOutputData &, double *gradient, int acenter, GaussianBasisSet *basis, const double *dmat_a, const double *dmat_b, int ncontrib_, const int *contrib_, int ncontrib_bf_, const int *contrib_bf_, const double *bs_values, const double *bsg_values, const double *bsh_values) (defined in sc::DenFunctional) sc::DenFunctional identifier() sc::Identity [inline] init_constants() (defined in sc::LYPCFunctional) sc::LYPCFunctional [protected] key_restore_state(StateIn &si, const char *keyword) sc::SavableState [static] lock_ptr() const sc::RefCount LYPCFunctional() (defined in sc::LYPCFunctional) sc::LYPCFunctional LYPCFunctional(const Ref< KeyVal > &) (defined in sc::LYPCFunctional) sc::LYPCFunctional LYPCFunctional(StateIn &) (defined in sc::LYPCFunctional) sc::LYPCFunctional managed() const (defined in sc::RefCount) sc::RefCount [inline] managed() const sc::RefCount [inline] need_density_gradient() (defined in sc::LYPCFunctional) sc::LYPCFunctional [virtual] need_density_hessian() (defined in sc::DenFunctional) sc::DenFunctional [virtual] nreference() const sc::RefCount [inline] operator=(const SavableState &) (defined in sc::SavableState) sc::SavableState operator=(const DescribedClass &) (defined in sc::DescribedClass) sc::DescribedClass operator=(const RefCount &) (defined in sc::RefCount) sc::RefCount [inline, protected] point(const PointInputData &, PointOutputData &) (defined in sc::LYPCFunctional) sc::LYPCFunctional [virtual] print(std::ostream &=ExEnv::out0()) const sc::DescribedClass [virtual] RefCount() (defined in sc::RefCount) sc::RefCount [inline, protected] RefCount(const RefCount &) (defined in sc::RefCount) sc::RefCount [inline, protected] reference() sc::RefCount [inline] restore_state(StateIn &si) sc::SavableState [static] SavableState() (defined in sc::SavableState) sc::SavableState [protected] SavableState(const SavableState &) (defined in sc::SavableState) sc::SavableState [protected] SavableState(StateIn &) sc::SavableState [protected] save_data_state(StateOut &) sc::LYPCFunctional [virtual] save_object_state(StateOut &) sc::SavableState save_state(StateOut &) sc::SavableState save_state(SavableState *s, StateOut &) (defined in sc::SavableState) sc::SavableState [static] save_vbase_state(StateOut &) sc::SavableState [virtual] set_compute_potential(int i) (defined in sc::DenFunctional) sc::DenFunctional [virtual] set_spin_polarized(int i) (defined in sc::DenFunctional) sc::DenFunctional [virtual] spin_polarized_ (defined in sc::DenFunctional) sc::DenFunctional [protected] test(const PointInputData &) (defined in sc::DenFunctional) sc::DenFunctional test() (defined in sc::DenFunctional) sc::DenFunctional unlock_ptr() const sc::RefCount unmanage() sc::RefCount [inline] use_locks(bool inVal) sc::RefCount ~DenFunctional() (defined in sc::DenFunctional) sc::DenFunctional ~DescribedClass() (defined in sc::DescribedClass) sc::DescribedClass [virtual] ~Identity() (defined in sc::Identity) sc::Identity [virtual] ~LYPCFunctional() (defined in sc::LYPCFunctional) sc::LYPCFunctional ~RefCount() (defined in sc::RefCount) sc::RefCount [virtual] ~SavableState() (defined in sc::SavableState) sc::SavableState [virtual]