sc::VWN3LCFunctional(3)

💖 NAME 💖

From the MPQC manual, bestie: sc::VWN3LCFunctional is lowkey the class that computes energies and densities using the VWN3 local correlation term — the one from Vosko, Wilk, and Nusair. That's the name section, periodt. ✨

✨ SYNOPSIS ✨

#include <functional.h>

Inherits sc::VWNLCFunctional. 💅

🎀 Public Member Functions 🎀

• VWN3LCFunctional (int mcp=1, int mce0=1) — constructor with int mcp=1 and int mce0=1; both defaults are literally right there in the signature, bestie.
• VWN3LCFunctional (const Ref< KeyVal > &) — constructor that takes a const Ref< KeyVal > &.
• VWN3LCFunctional (StateIn &) — constructor that takes a StateIn &.
• void save_data_state (StateOut &) — saves the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them. More deets down in Member Function Documentation. 👑
• void point_lc (const PointInputData &, PointOutputData &, double &, double &, double &) — the signature is exactly this; the page doesn't give a separate description for it, so no invented lore, just the facts. 🙈

🧚 Protected Attributes 🧚

• int monte_carlo_prefactor_ — protected attribute, typed int, named monte_carlo_prefactor_.
• int monte_carlo_e0_ — protected attribute, typed int, named monte_carlo_e0_.

These are protected, so respect the boundary, fr fr. 🫶

🌈 Additional Inherited Members 🌈

The manpage has this section heading, but no extra inherited members are listed under it in the source text. It's giving minimalist 💀 — but it's still part of the page, so it stays.

💅 Detailed Description 💅

Okay so for real: sc::VWN3LCFunctional computes energies and densities using the VWN3 local correlation term (from Vosko, Wilk, and Nusair). Same energy as the NAME section — the manual repeats it here, and we are not skipping it. No cap. 🔥

👑 Member Function Documentation 👑

void sc::VWN3LCFunctional::save_data_state (StateOut &) [virtual]

This one is marked [virtual]. The manual says: “Save the base classes (with save_data_state) and the members in the same order that the StateIn CTOR initializes them.” It also says: “This must be implemented by the derived class if the class has data.” So if you're deriving and your class has data, that's on you, bestie. 😭

Reimplemented from sc::VWNLCFunctional. 🫶

🦋 Author 🦋

Generated automatically by Doxygen for MPQC from the source code. Not a human author — a doc generator did this, and honestly it ate. 💅

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okay bye bestie 💖 — this page comes from the MPQC manual, version 2.3.1, dated Sun Oct 4 2020, and the page tag is sc::VWN3LCFunctional(3). mwah 🎀✨