sc::ShellPairCints(3)

📦
version 2.3.1 · 5 versions
, in ubuntu jammy

💅 sc::ShellPairCints(3) — the MPQC manual page, bestie edition 💅

okay so this is the sc::ShellPairCints(3) page from the MPQC manual, and it's literally all about primitive pair data for a shell pair. no cap, it's very niche and very iconic. 🫶

🌸 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 > &) — exact signature from the page, character for character. no extra notes in the original, so I'm not inventing any. ✨
  • ShellPairCints (StateIn &) — another exact signature, copy-pasted with love. 🎀
  • 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 must be implemented by the derived class if the class has data. Reimplemented from sc::SavableState. 🔥
  • void init (const int, const int) — exact signature, no extras. 💅
  • prim_pair_t * prim_pair (int p1, int p2) const — exact signature, no extras. 🦋
  • double prim_pair_P (int p1, int p2, int xyz) const — exact signature, no extras. 🌈
  • double prim_pair_gamma (int p1, int p2) const — exact signature, no extras. ⭐
  • double prim_pair_ovlp (int p1, int p2) const — exact signature, no extras. 💜

🫶 Friends 🫶

  • void init_shell_pair (ShellPairsCints &) — the friend declaration, exactly as listed. no side quests. 🧚

🌀 Additional Inherited Members 🌀

the original just puts this heading here and then rolls straight into the detailed description. no extra member list is printed, bestie. 🍓

👑 Detailed Description 👑

ShellPairCints provides all primitive pair data for a given shell pair. that's the whole detailed description — short, sweet, and main character energy. 💖

💀 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. 💫

💖 cute little footer sign-off: MPQC source / version 2.3.1 · Sun Oct 4 2020 💖 — mwah, go read the source, bestie 🫶

📦 where this page comes from