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# sc::FinDispMolecularHessian Member List

This is the complete list of members for sc::FinDispMolecularHessian, including all inherited members.

- accuracy_ (defined in sc::FinDispMolecularHessian)`[protected]`
- cartesian_hessian()
- cartesian_to_symmetry(const Ref< Molecule > &m, Ref< PointGroup > pg=0, Ref< SCMatrixKit > kit=0) (defined in sc::MolecularHessian)`[static]`
- checkpoint() const `[inline]`
- checkpoint_ (defined in sc::FinDispMolecularHessian)`[protected]`
- checkpoint_displacements(StateOut &) (defined in sc::FinDispMolecularHessian)
- checkpoint_file_ (defined in sc::FinDispMolecularHessian)`[protected]`
- class_desc() const
- class_name() const
- class_version() const
- compute_hessian_from_gradients()
- d3natom() const (defined in sc::FinDispMolecularHessian)`[inline]`
- d3natom() (defined in sc::MolecularHessian)
- d3natom_ (defined in sc::MolecularHessian)`[protected]`
- debug_ (defined in sc::FinDispMolecularHessian)`[protected]`
- dereference() `[inline]`
- DescribedClass() (defined in sc::DescribedClass)
- DescribedClass(const DescribedClass &) (defined in sc::DescribedClass)
- dir_restore_state(StateIn &si, const char *objectname, const char *keyword=0) (defined in sc::SavableState)`[static]`
- disp_ (defined in sc::FinDispMolecularHessian)`[protected]`
- displace(int disp) (defined in sc::FinDispMolecularHessian)
- displacement_point_group_ (defined in sc::FinDispMolecularHessian)`[protected]`
- displacements(int irrep) const (defined in sc::FinDispMolecularHessian)
- do_hess_for_irrep(int irrep, const RefSymmSCMatrix &dhessian, const RefSymmSCMatrix &xhessian) (defined in sc::FinDispMolecularHessian)`[protected]`
- do_null_displacement_ (defined in sc::FinDispMolecularHessian)`[protected]`
- eliminate_cubic_terms_ (defined in sc::FinDispMolecularHessian)`[protected]`
- energy() const (defined in sc::FinDispMolecularHessian)
- FinDispMolecularHessian(const Ref< MolecularEnergy > &) (defined in sc::FinDispMolecularHessian)
- FinDispMolecularHessian(const Ref< KeyVal > &) (defined in sc::FinDispMolecularHessian)
- FinDispMolecularHessian(StateIn &) (defined in sc::FinDispMolecularHessian)
- get_disp(int disp, int &irrep, int &index, double &coef) (defined in sc::FinDispMolecularHessian)`[protected]`
- gradients_ (defined in sc::FinDispMolecularHessian)`[protected]`
- identifier() `[inline]`
- init() (defined in sc::FinDispMolecularHessian)`[protected]`
- key_restore_state(StateIn &si, const char *keyword) `[static]`
- lock_ptr() const
- managed() const `[inline]`
- managed() const `[inline]`
- matrixkit() const (defined in sc::FinDispMolecularHessian)`[inline]`
- matrixkit_ (defined in sc::MolecularHessian)`[protected]`
- mol_ (defined in sc::MolecularHessian)`[protected]`
- mole_ (defined in sc::FinDispMolecularHessian)`[protected]`
- MolecularHessian() (defined in sc::MolecularHessian)
- MolecularHessian(const Ref< KeyVal > &) (defined in sc::MolecularHessian)
- MolecularHessian(StateIn &) (defined in sc::MolecularHessian)
- ndisp_ (defined in sc::FinDispMolecularHessian)`[protected]`
- ndisplace() const (defined in sc::FinDispMolecularHessian)
- ndisplacements_done() const (defined in sc::FinDispMolecularHessian)`[inline]`
- nirrep_ (defined in sc::FinDispMolecularHessian)`[protected]`
- nreference() const `[inline]`
- only_totally_symmetric_ (defined in sc::FinDispMolecularHessian)`[protected]`
- operator=(const SavableState &) (defined in sc::SavableState)
- operator=(const DescribedClass &) (defined in sc::DescribedClass)
- operator=(const RefCount &) (defined in sc::RefCount)`[inline, protected]`
- original_geometry() (defined in sc::FinDispMolecularHessian)
- original_geometry_ (defined in sc::FinDispMolecularHessian)`[protected]`
- original_point_group_ (defined in sc::FinDispMolecularHessian)`[protected]`
- print(std::ostream &=ExEnv::out0()) const `[virtual]`
- read_cartesian_hessian(const char *filename, const Ref< Molecule > &m, const RefSymmSCMatrix &hess) (defined in sc::MolecularHessian)`[static]`
- RefCount() (defined in sc::RefCount)`[inline, protected]`
- RefCount(const RefCount &) (defined in sc::RefCount)`[inline, protected]`
- reference() `[inline]`
- restart() (defined in sc::FinDispMolecularHessian)`[protected]`
- restart_ (defined in sc::FinDispMolecularHessian)`[protected]`
- restart_file_ (defined in sc::FinDispMolecularHessian)`[protected]`
- restore_displacements(StateIn &) (defined in sc::FinDispMolecularHessian)
- restore_state(StateIn &si) `[static]`
- SavableState() (defined in sc::SavableState)`[protected]`
- SavableState(const SavableState &) (defined in sc::SavableState)`[protected]`
- SavableState(StateIn &) `[protected]`
- save_data_state(StateOut &) `[virtual]`
- save_object_state(StateOut &)
- save_state(StateOut &)
- save_state(SavableState *s, StateOut &) (defined in sc::SavableState)`[static]`
- save_vbase_state(StateOut &) `[virtual]`
- set_checkpoint(int c) `[inline]`
- set_energy(const Ref< MolecularEnergy > &energy) (defined in sc::FinDispMolecularHessian)
- set_gradient(int disp, const RefSCVector &grad) (defined in sc::FinDispMolecularHessian)
- symbasis_ (defined in sc::FinDispMolecularHessian)`[protected]`
- unlock_ptr() const
- unmanage() `[inline]`
- use_locks(bool inVal)
- write_cartesian_hessian(const char *filename, const Ref< Molecule > &m, const RefSymmSCMatrix &hess) (defined in sc::MolecularHessian)`[static]`
- ~DescribedClass() (defined in sc::DescribedClass)`[virtual]`
- ~FinDispMolecularHessian() (defined in sc::FinDispMolecularHessian)
- ~Identity() (defined in sc::Identity)`[virtual]`
- ~MolecularHessian() (defined in sc::MolecularHessian)
- ~RefCount() (defined in sc::RefCount)`[virtual]`
- ~SavableState() (defined in sc::SavableState)`[virtual]`