sc_ShellPairsCints man page

sc::ShellPairsCints — ShellPairsCints contains primitive pair data for all shell pairs.

Synopsis

#include <shellpairs.h>

Inherits sc::SavableState.

Public Member Functions

ShellPairsCints (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 &)

Additional Inherited Members

Detailed Description

ShellPairsCints contains primitive pair data for all shell pairs.

Member Function Documentation

void sc::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.

Author

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Info

Fri May 6 2016 Version 2.3.1 MPQC