sc_OSSHF man page

sc::OSSHF —

Synopsis

Inherits sc::OSSSCF.

Public Member Functions

OSSHF (StateIn &)

OSSHF (const Ref< KeyVal > &)

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.
void print (std::ostream &o=ExEnv::out0()) const
Print information about the object.
void two_body_energy (double &ec, double &ex)

int value_implemented () const
Information about the availability of values, gradients, and hessians.
int gradient_implemented () const

Protected Member Functions

void ao_fock (double accuracy)

void two_body_deriv (double *)

Additional Inherited Members

Member Function Documentation

void sc::OSSHF::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::MolecularEnergy.

int sc::OSSHF::value_implemented () const [virtual]

Information about the availability of values, gradients, and hessians.

Reimplemented from sc::Function.

Author

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Info

Fri May 6 2016 Version 2.3.1 MPQC