sc::SpatialMOPairIter_neq(3)

✨ NAME ✨

okay bestie, this is the page for sc::SpatialMOPairIter_neq, from manual section 3 — literally sc::SpatialMOPairIter_neq(3) 💅. It gives the ordering of pairs of spatial orbitals from different spaces. periodt.

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🌸 SYNOPSIS 🌸

#include <pairiter.h>

Inherits sc::SpatialMOPairIter. no cap.

🎀 Public Member Functions 🎀

• SpatialMOPairIter_neq (const Ref< MOIndexSpace > &space1, const Ref< MOIndexSpace > &space2) — Initialize an iterator for the given MO spaces.
• void start (const int ij_offset=0) — Initialize the iterator assuming that iteration will start with pair ij_offset.
• void next () — Move to the next pair.
• operator int () const — Returns nonzero if the iterator currently hold valid data.
• int nij_aa () const — Returns the number of functions in alpha-alpha space.
• int nij_ab () const — Returns the number of functions in alpha-beta space.
• int ij_aa () const — Returns compound index ij for alpha-alpha case.
• int ij_ab () const — Returns compound index ij for alpha-beta case.
• int ij_ba () const — Returns compound index ij for beta-alpha case.

🦋 Additional Inherited Members 🦋

This heading is here on the page, but no extra inherited members are listed under it. That’s literally all it gives us, bestie 🫶.

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💖 Detailed Description 💖

SpatialMOPairIter_neq gives the ordering of pairs of spatial orbitals from different spaces.

It iterates over all ij combinations (total of ni_*nj_ pairs). slay.

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🌟 Author 🌟

Generated automatically by Doxygen for MPQC from the source code.

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Bye bestie 🎀 — this iconic little page says Version 2.3.1, dated Sun Oct 4 2020, and it came from MPQC via Doxygen. 💜