sc::canonical_aabc(3)

🎀 NAME 🎀

okay so this is sc::canonical_aabc(3), a page from the MPQC manual, bestie 💖

sc::canonical_aabc — if the shell loop structure has 2 fold symmetry between the first two indices, then this should be used as the template argument to GPetite4. periodt. ✨

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🌸 SYNOPSIS 🌸

#include <gpetite.h>

✨ Public Member Functions ✨

• canonical_aabc — the constructor, and yes it takes four basis-set refs, no cap 🫶

canonical_aabc (const Ref< GaussianBasisSet > bi, const Ref<
    GaussianBasisSet > bj, const Ref< GaussianBasisSet > bk, const Ref<
    GaussianBasisSet > bl)

• offset — the offset function, serving exactly this signature 💅

sc_int_least64_t offset (int i, int j, int k, int l)

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🦋 Detailed Description 🦋

If the shell loop structure has 2 fold symmetry between the first two indices, then this should be used as the template argument to GPetite4. that's the whole vibe check, bestie. 🧚

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👑 Author 👑

Generated automatically by Doxygen for MPQC from the source code. iconic automated behavior, honestly. ⭐

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Version 2.3.1 · Sun Oct 4 2020 — that’s the MPQC manual footer, bestie, mwah 💋🎀