sc::ShellPairsCints(3)

🦋 sc::ShellPairsCints(3) — MPQC man page 🦋

Welcome to the sc::ShellPairsCints(3) page, bestie. It’s an MPQC class page and it’s literally about shell pair data. Let’s get into it. 💅

✨ NAME ✨

sc::ShellPairsCints — the class that contains primitive pair data for all shell pairs. That’s the whole name vibe. No cap. 💖

🌸 SYNOPSIS 🌸

#include <shellpairs.h>

Inherits sc::SavableState.

💅 Public Member Functions 💅

• ShellPairsCints (const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &) — constructor with two GaussianBasisSet refs, bestie. ✨
• ShellPairsCints (const Ref< ShellPairsCints > &) — copy-constructor situation. 🫶
• ShellPairsCints (const Ref< KeyVal > &) — the KeyVal constructor. 💜
• ShellPairsCints (StateIn &) — the StateIn constructor. 🎀
• 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. This is important, okay? 😭
• ShellPairCints * shell_pair (int si, int sj) const — gives you a ShellPairCints * for si and sj. Iconic. 👑

🫶 Friends 🫶

• void init_shell_pair (ShellPairsCints &) — friend function, very bestie-coded. 💖

👑 Additional Inherited Members 👑

The original man page just has this heading and no extra listed deets under it, so we’re not inventing any. Periodt. 💅

🌈 Detailed Description 🌈

ShellPairsCints contains primitive pair data for all shell pairs. That’s it, that’s the description, and honestly it ate. 🍓

🔥 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 🌟

Generated automatically by Doxygen for MPQC from the source code.

🫶 That’s the page, bestie. MPQC version 2.3.1, dated Sun Oct 4 2020 — stay slay and keep those primitive pairs close. 💖✨