sc::OneBodyDerivIntCCA(3)

📦
version 2.3.1 · 5 versions
, in ubuntu jammy

💅 sc::OneBodyDerivIntCCA(3) 💅

okay bestie, this is the MPQC manual page for sc::OneBodyDerivIntCCA(3) — yes, the whole page, every tiny detail, and we're gonna make it make sense. 🫶✨

✨ NAME ✨

sc::OneBodyDerivIntCCA — This implements one body derivative integrals. periodt. 💖

💖 SYNOPSIS 💖

#include <obintcca.h>

it inherits from sc::OneBodyDerivInt, lowkey important. 🦋

🌸 Public Member Functions 🌸

  • OneBodyDerivIntCCA (Integral *, const Ref< GaussianBasisSet > &, const Ref< GaussianBasisSet > &, IntegralEvaluatorFactory, bool, string) — the constructor, with all those args exactly as written, no edits. 👑
  • void compute_shell (int, int, DerivCenters &) — compute the derivative integrals and place the result in the buffer returned by buffer(). slay. ✨
  • void compute_shell (int, int, int) — compute the derivative integrals with respect to the given center and place the result in the buffer returned by buffer(). 💅

🦋 Protected Types 🦋

  • typedef void(Int1eCCA::* IntegralFunction) (int, int, DerivCenters &) — that's the protected typedef, character for character. 🎀

🎀 Protected Attributes 🎀

  • Ref< Int1eCCA > int1ecca_ — the protected attribute, exactly like that. 💜

🌈 Additional Inherited Members 🌈

yep, this section is here too: Additional Inherited Members. no extra details given, so we're not inventing any. 🙈

👑 Detailed Description 👑

This implements one body derivative integrals. icon behavior. 🔥

It is given a function pointer to the Int1eCCA member that computes the particular integral of interest. iykyk. 🌟

💌 Author 💌

Generated automatically by Doxygen for MPQC from the source code. 💖

and that's the whole vibe, bestie — Version 2.3.1 • Sun Oct 4 2020 • sc::OneBodyDerivIntCCA(3) • MPQC, byeeee 🫶💅

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