sc::DiagMolecularHessian - DiagMolecularHessian is an implementation of MolecularHessian that returns a

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Version 2.3.1                                    Sun Oct 4 2020                      sc::DiagMolecularHessian(3)

sc::DiagMolecularHessian::DiagMolecularHessian(constRef<KeyVal>&)
       The DiagMolecularHessianKeyVal constructor is used to generate a DiagMolecularHessian object from the
       input. It reads the keywords below.

       KeywordTypeDefaultDescription diagdouble1.0Specifies the diagonal elements of the hessian.

DiagMolecularHessian is an implementation of MolecularHessian that returns a hessian that is a diagonal
       matrix.

voidsc::DiagMolecularHessian::save_data_state(StateOut&)[virtual]
       Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR
       initializes them. This must be implemented by the derived class if the class has data.

       Reimplemented from sc::MolecularHessian.

       sc::DiagMolecularHessian - DiagMolecularHessian is an implementation of MolecularHessian that returns a
       hessian that is a diagonal matrix.

       #include <hess.h>

       Inherits sc::MolecularHessian.

   PublicMemberFunctionsDiagMolecularHessian (const Ref< KeyVal > &)
           The DiagMolecularHessianKeyVal constructor is used to generate a DiagMolecularHessian object from
           the input.
       DiagMolecularHessian (StateIn &)
       void save_data_state (StateOut &)
           Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR
           initializes them.
       RefSymmSCMatrixcartesian_hessian ()
           Return the hessian in cartesian coordinates.

   ProtectedAttributes
       double diag_AdditionalInheritedMembers