sc::ShellPairsCints - ShellPairsCints contains primitive pair data for all shell pairs.
Contents
Detailed Description
ShellPairsCints contains primitive pair data for all shell pairs.
Member Function Documentation
voidsc::ShellPairsCints::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::SavableState.
Name
sc::ShellPairsCints - ShellPairsCints contains primitive pair data for all shell pairs.
Synopsis
#include <shellpairs.h>
Inherits sc::SavableState.
PublicMemberFunctionsShellPairsCints (const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &)
ShellPairsCints (const Ref< ShellPairsCints > &)
ShellPairsCints (const Ref< KeyVal > &)
ShellPairsCints (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.
ShellPairCints * shell_pair (int si, int sj) const
Friends
void init_shell_pair (ShellPairsCints &)
AdditionalInheritedMembers