DragonFly On-Line Manual Pages

Search: Section:  

sc::ShellPairCints(3)                MPQC                sc::ShellPairCints(3)


NAME

       sc::ShellPairCints - ShellPairCints provides all primitive pair data
       for a given shell pair.


SYNOPSIS

       #include <shellpairs.h>

       Inherits sc::SavableState.

   Public Member Functions
       ShellPairCints (Ref< PrimPairsCints > &)
       ShellPairCints (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.
       void init (const int, const int)
       prim_pair_t * prim_pair (int p1, int p2) const
       double prim_pair_P (int p1, int p2, int xyz) const
       double prim_pair_gamma (int p1, int p2) const
       double prim_pair_ovlp (int p1, int p2) const

   Friends
       void init_shell_pair (ShellPairsCints &)

   Additional Inherited Members

Detailed Description
       ShellPairCints provides all primitive pair data for a given shell pair.

Member Function Documentation
   void sc::ShellPairCints::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
       Generated automatically by Doxygen for MPQC from the source code.

Version 2.3.1                   Fri Feb 19 2016          sc::ShellPairCints(3)

Search: Section: