sc::SphericalTr...mComponentCints(3)

💅 sc::SphericalTr...mComponentCints(3) 💅 — the MPQC manual page

Bestie, welcome to the MPQC page for sc::SphericalTr...mComponentCints(3). It’s giving niche C++ energy, and we’re gonna get through it together 🫶

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✨ NAME ✨

sc::SphericalTransformComponentCints — yes, that’s the full name. The title up top is just doing its little truncated thing, iykyk 💅

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🌸 SYNOPSIS 🌸

Inherits sc::SphericalTransformComponent.

💖 Public Member Functions 💖

• void init (int a, int b, int c, double coef, int pureindex) — Initialize this object. That’s the whole public member-function lineup, bestie ✨

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🦋 Additional Inherited Members 🦋

This is the inherited-members section — the page doesn’t spell out extra items under this heading. It’s just vibing there, lowkey 🫶

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🔥 Member Function Documentation 🔥

🎀 init — the main character 🎀

void sc::SphericalTransformComponentCints::init (int a, int b, int c, double coef, int pureindex) [inline],  [virtual]

Initialize this object. This must be provided in all specializations of this class to establish the ordering between a, b, and c and the index of the Cartesian basis function. Other things such as adjustment of the coefficient to account for normalization differences can be done as well.

The default SphericalTransform::init() implementation requires that only the xl, yl, and zl basis functions are normalized to unity. No cap, that’s the rule 🌈

Implements sc::SphericalTransformComponent.

References:

• sc::SphericalTransformComponent::a()
• sc::SphericalTransformComponent::b()
• sc::SphericalTransformComponent::c()
• sc::SphericalTransformComponent::coef()
• sc::SphericalTransformComponent::pureindex()

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👑 Author 👑

Generated automatically by Doxygen for MPQC from the source code. Iconic Doxygen behavior, honestly 💅

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Bye bestie 🫶 — this was Version 2.3.1, Sun Oct 4. Mwah! 💋🎀