NAME
sc::MP2BasisExtrap -
SYNOPSIS
Inherits sc::SumMolecularEnergy.
Public Member Functions
MP2BasisExtrap (const Ref< KeyVal > &)
MP2BasisExtrap (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.
Protected Member Functions
void compute ()
Recompute at least the results that have compute true and are not
already computed.
Member Function Documentation
void sc::MP2BasisExtrap::compute () [protected, virtual]
Recompute at least the results that have compute true and are not
already computed. This should only be called by Result’s members.
Reimplemented from sc::SumMolecularEnergy.
void sc::MP2BasisExtrap::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::SumMolecularEnergy.
Author
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